The rectified linear unit (ReLU) is a highly successful activation function in neural networks as it allows networks to easily obtain sparse representations, which reduces overfitting in overparameterized networks. However, in network pruning, we find that the sparsity introduced by ReLU, which we quantify by a term called dynamic dead neuron rate (DNR), is not beneficial for the pruned network. Interestingly, the more the network is pruned, the smaller the dynamic DNR becomes during optimization. This motivates us to propose a method to explicitly reduce the dynamic DNR for the pruned network, i.e., de-sparsify the network. We refer to our method as Activating-while-Pruning (AP). We note that AP does not function as a stand-alone method, as it does not evaluate the importance of weights. Instead, it works in tandem with existing pruning methods and aims to improve their performance by selective activation of nodes to reduce the dynamic DNR. We conduct extensive experiments using popular networks (e.g., ResNet, VGG) via two classical and three state-of-the-art pruning methods. The experimental results on public datasets (e.g., CIFAR-10/100) suggest that AP works well with existing pruning methods and improves the performance by 3% - 4%. For larger scale datasets (e.g., ImageNet) and state-of-the-art networks (e.g., vision transformer), we observe an improvement of 2% - 3% with AP as opposed to without. Lastly, we conduct an ablation study to examine the effectiveness of the components comprising AP.

The publication time of a document carries a relevant information about its semantic content. The Dirichlet-Hawkes process has been proposed to jointly model textual information and publication dynamics. This approach has been used with success in several recent works, and extended to tackle specific challenging problems --typically for short texts or entangled publication dynamics. However, the prior in its current form does not allow for complex publication dynamics. In particular, inferred topics are independent from each other --a publication about finance is assumed to have no influence on publications about politics, for instance. In this work, we develop the Multivariate Powered Dirichlet-Hawkes Process (MPDHP), that alleviates this assumption. Publications about various topics can now influence each other. We detail and overcome the technical challenges that arise from considering interacting topics. We conduct a systematic evaluation of MPDHP on a range of synthetic datasets to define its application domain and limitations. Finally, we develop a use case of the MPDHP on Reddit data. At the end of this article, the interested reader will know how and when to use MPDHP, and when not to.

In recent years, Multi-Agent Path Finding (MAPF) has attracted attention from the fields of both Operations Research (OR) and Reinforcement Learning (RL). However, in the 2021 Flatland3 Challenge, a competition on MAPF, the best RL method scored only 27.9, far less than the best OR method. This paper proposes a new RL solution to Flatland3 Challenge, which scores 125.3, several times higher than the best RL solution before. We creatively apply a novel network architecture, TreeLSTM, to MAPF in our solution. Together with several other RL techniques, including reward shaping, multiple-phase training, and centralized control, our solution is comparable to the top 2-3 OR methods.

Risk management in many environmental settings requires an understanding of the mechanisms that drive extreme events. Useful metrics for quantifying such risk are extreme quantiles of response variables conditioned on predictor variables that describe, e.g., climate, biosphere and environmental states. Typically these quantiles lie outside the range of observable data and so, for estimation, require specification of parametric extreme value models within a regression framework. Classical approaches in this context utilise linear or additive relationships between predictor and response variables and suffer in either their predictive capabilities or computational efficiency; moreover, their simplicity is unlikely to capture the truly complex structures that lead to the creation of extreme wildfires. In this paper, we propose a new methodological framework for performing extreme quantile regression using artificial neutral networks, which are able to capture complex non-linear relationships and scale well to high-dimensional data. The ``black box" nature of neural networks means that they lack the desirable trait of interpretability often favoured by practitioners; thus, we unify linear, and additive, regression methodology with deep learning to create partially-interpretable neural networks that can be used for statistical inference but retain high prediction accuracy. To complement this methodology, we further propose a novel point process model for extreme values which overcomes the finite lower-endpoint problem associated with the generalised extreme value class of distributions. Efficacy of our unified framework is illustrated on U.S. wildfire data with a high-dimensional predictor set and we illustrate vast improvements in predictive performance over linear and spline-based regression techniques.

Out-of-distribution generalization (OODG) is a longstanding challenge for neural networks. This challenge is quite apparent in tasks with well-defined variables and rules, where explicit use of the rules could solve problems independently of the particular values of the variables, but networks tend to be tied to the range of values sampled in their training data. Large transformer-based language models have pushed the boundaries on how well neural networks can solve previously unseen problems, but their complexity and lack of clarity about the relevant content in their training data obfuscates how they achieve such robustness. As a step toward understanding how transformer-based systems generalize, we explore the question of OODG in small scale transformers trained with examples from a known distribution. Using a reasoning task based on the puzzle Sudoku, we show that OODG can occur on a complex problem if the training set includes examples sampled from the whole distribution of simpler component tasks. Successful generalization depends on carefully managing positional alignment when absolute position encoding is used, but we find that suppressing sensitivity to absolute positions overcomes this limitation. Taken together our results represent a small step toward understanding and promoting systematic generalization in transformers.

Network embedding has emerged as a promising research field for network analysis. Recently, an approach, named Barlow Twins, has been proposed for self-supervised learning in computer vision by applying the redundancy-reduction principle to the embedding vectors corresponding to two distorted versions of the image samples. Motivated by this, we propose Barlow Graph Auto-Encoder, a simple yet effective architecture for learning network embedding. It aims to maximize the similarity between the embedding vectors of immediate and larger neighborhoods of a node, while minimizing the redundancy between the components of these projections. In addition, we also present the variation counterpart named as Barlow Variational Graph Auto-Encoder. Our approach yields promising results for inductive link prediction and is also on par with state of the art for clustering and downstream node classification, as demonstrated by extensive comparisons with several well-known techniques on three benchmark citation datasets.

The multi-armed bandit(MAB) problem is a simple yet powerful framework that has been extensively studied in the context of decision-making under uncertainty. In many real-world applications, such as robotic applications, selecting an arm corresponds to a physical action that constrains the choices of the next available arms (actions). Motivated by this, we study an extension of MAB called the graph bandit, where an agent travels over a graph to maximize the reward collected from different nodes. The graph defines the agent's freedom in selecting the next available nodes at each step. We assume the graph structure is fully available, but the reward distributions are unknown. Built upon an offline graph-based planning algorithm and the principle of optimism, we design a learning algorithm, \texttt{G-UCB}, that balances long-term exploration-exploitation using the principle of optimism. We show that our proposed algorithm achieves $O(\sqrt{|S|T\log(T)}+D|S|\log T)$ learning regret, where $|S|$ is the number of nodes and $D$ is the diameter of the graph, which matches the theoretical lower bound $\Omega(\sqrt{|S|T})$ up to logarithmic factors. To our knowledge, this result is among the first tight regret bounds in non-episodic, un-discounted learning problems with known deterministic transitions. Numerical experiments confirm that our algorithm outperforms several benchmarks.

The evaluation of clustering algorithms can involve running them on a variety of benchmark problems, and comparing their outputs to the reference, ground-truth groupings provided by experts. Unfortunately, many research papers and graduate theses consider only a small number of datasets. Also, the fact that there can be many equally valid ways to cluster a given problem set is rarely taken into account. In order to overcome these limitations, we have developed a framework whose aim is to introduce a consistent methodology for testing clustering algorithms. Furthermore, we have aggregated, polished, and standardised many clustering benchmark dataset collections referred to across the machine learning and data mining literature, and included new datasets of different dimensionalities, sizes, and cluster types. An interactive datasets explorer, the documentation of the Python API, a description of the ways to interact with the framework from other programming languages such as R or MATLAB, and other details are all provided at .

Speech emotion conversion is the task of modifying the perceived emotion of a speech utterance while preserving the lexical content and speaker identity. In this study, we cast the problem of emotion conversion as a spoken language translation task. We use a decomposition of the speech signal into discrete learned representations, consisting of phonetic-content units, prosodic features, speaker, and emotion. First, we modify the speech content by translating the phonetic-content units to a target emotion, and then predict the prosodic features based on these units. Finally, the speech waveform is generated by feeding the predicted representations into a neural vocoder. Such a paradigm allows us to go beyond spectral and parametric changes of the signal, and model non-verbal vocalizations, such as laughter insertion, yawning removal, etc. We demonstrate objectively and subjectively that the proposed method is vastly superior to current approaches and even beats text-based systems in terms of perceived emotion and audio quality. We rigorously evaluate all components of such a complex system and conclude with an extensive model analysis and ablation study to better emphasize the architectural choices, strengths and weaknesses of the proposed method. Samples are available under the following link: https://speechbot.github.io/emotion.

Although massive pre-trained vision-language models like CLIP show impressive generalization capabilities for many tasks, still it often remains necessary to fine-tune them for improved performance on specific datasets. When doing so, it is desirable that updating the model is fast and that the model does not lose its capabilities on data outside of the dataset, as is often the case with classical fine-tuning approaches. In this work we suggest a lightweight adapter, that only updates the models predictions close to seen datapoints. We demonstrate the effectiveness and speed of this relatively simple approach in the context of few-shot learning, where our results both on classes seen and unseen during training are comparable with or improve on the state of the art.

Denoising diffusion probabilistic models (DDPMs) have been shown to have superior performances in MRI reconstruction. From the perspective of continuous stochastic differential equations (SDEs), the reverse process of DDPM can be seen as maximizing the energy of the reconstructed MR image, leading to SDE sequence divergence. For this reason, a modified high-frequency DDPM model is proposed for MRI reconstruction. From its continuous SDE viewpoint, termed high-frequency space SDE (HFS-SDE), the energy concentrated low-frequency part of the MR image is no longer amplified, and the diffusion process focuses more on acquiring high-frequency prior information. It not only improves the stability of the diffusion model but also provides the possibility of better recovery of high-frequency details. Experiments on the publicly fastMRI dataset show that our proposed HFS-SDE outperforms the DDPM-driven VP-SDE, supervised deep learning methods and traditional parallel imaging methods in terms of stability and reconstruction accuracy.

In this paper we explore whether the fundamental tool of experimental psychology, the behavioral experiment, has the power to generate insight not only into humans and animals, but artificial systems too. We apply the techniques of experimental psychology to investigating catastrophic forgetting in neural networks. We present a series of controlled experiments with two-layer ReLU networks, and exploratory results revealing a new understanding of the behavior of catastrophic forgetting. Alongside our empirical findings, we demonstrate an alternative, behavior-first approach to investigating neural network phenomena.

Visualization methods based on the nearest neighbor graph, such as t-SNE or UMAP, are widely used for visualizing high-dimensional data. Yet, these approaches only produce meaningful results if the nearest neighbors themselves are meaningful. For images represented in pixel space this is not the case, as distances in pixel space are often not capturing our sense of similarity and therefore neighbors are not semantically close. This problem can be circumvented by self-supervised approaches based on contrastive learning, such as SimCLR, relying on data augmentation to generate implicit neighbors, but these methods do not produce two-dimensional embeddings suitable for visualization. Here, we present a new method, called t-SimCNE, for unsupervised visualization of image data. T-SimCNE combines ideas from contrastive learning and neighbor embeddings, and trains a parametric mapping from the high-dimensional pixel space into two dimensions. We show that the resulting 2D embeddings achieve classification accuracy comparable to the state-of-the-art high-dimensional SimCLR representations, thus faithfully capturing semantic relationships. Using t-SimCNE, we obtain informative visualizations of the CIFAR-10 and CIFAR-100 datasets, showing rich cluster structure and highlighting artifacts and outliers.

Inspired by the impressive success of contrastive learning (CL), a variety of graph augmentation strategies have been employed to learn node representations in a self-supervised manner. Existing methods construct the contrastive samples by adding perturbations to the graph structure or node attributes. Although impressive results are achieved, it is rather blind to the wealth of prior information assumed: with the increase of the perturbation degree applied on the original graph, 1) the similarity between the original graph and the generated augmented graph gradually decreases; 2) the discrimination between all nodes within each augmented view gradually increases. In this paper, we argue that both such prior information can be incorporated (differently) into the contrastive learning paradigm following our general ranking framework. In particular, we first interpret CL as a special case of learning to rank (L2R), which inspires us to leverage the ranking order among positive augmented views. Meanwhile, we introduce a self-ranking paradigm to ensure that the discriminative information among different nodes can be maintained and also be less altered to the perturbations of different degrees. Experiment results on various benchmark datasets verify the effectiveness of our algorithm compared with the supervised and unsupervised models.

Exploratory data analytics (EDA) is a sequential decision making process where analysts choose subsequent queries that might lead to some interesting insights based on the previous queries and corresponding results. Data processing systems often execute the queries on samples to produce results with low latency. Different downsampling strategy preserves different statistics of the data and have different magnitude of latency reductions. The optimum choice of sampling strategy often depends on the particular context of the analysis flow and the hidden intent of the analyst. In this paper, we are the first to consider the impact of sampling in interactive data exploration settings as they introduce approximation errors. We propose a Deep Reinforcement Learning (DRL) based framework which can optimize the sample selection in order to keep the analysis and insight generation flow intact. Evaluations with 3 real datasets show that our technique can preserve the original insight generation flow while improving the interaction latency, compared to baseline methods.

Adversarial images are created with the intention of causing an image classifier to produce a misclassification. In this paper, we propose that adversarial images should be evaluated based on semantic mismatch, rather than label mismatch, as used in current work. In other words, we propose that an image of a "mug" would be considered adversarial if classified as "turnip", but not as "cup", as current systems would assume. Our novel idea of taking semantic misclassification into account in the evaluation of adversarial images offers two benefits. First, it is a more realistic conceptualization of what makes an image adversarial, which is important in order to fully understand the implications of adversarial images for security and privacy. Second, it makes it possible to evaluate the transferability of adversarial images to a real-world classifier, without requiring the classifier's label set to have been available during the creation of the images. The paper carries out an evaluation of a transfer attack on a real-world image classifier that is made possible by our semantic misclassification approach. The attack reveals patterns in the semantics of adversarial misclassifications that could not be investigated using conventional label mismatch.

We propose a novel model agnostic data-driven reliability analysis framework for time-dependent reliability analysis. The proposed approach -- referred to as MAntRA -- combines interpretable machine learning, Bayesian statistics, and identifying stochastic dynamic equation to evaluate reliability of stochastically-excited dynamical systems for which the governing physics is \textit{apriori} unknown. A two-stage approach is adopted: in the first stage, an efficient variational Bayesian equation discovery algorithm is developed to determine the governing physics of an underlying stochastic differential equation (SDE) from measured output data. The developed algorithm is efficient and accounts for epistemic uncertainty due to limited and noisy data, and aleatoric uncertainty because of environmental effect and external excitation. In the second stage, the discovered SDE is solved using a stochastic integration scheme and the probability failure is computed. The efficacy of the proposed approach is illustrated on three numerical examples. The results obtained indicate the possible application of the proposed approach for reliability analysis of in-situ and heritage structures from on-site measurements.

Membership inference attacks (MIAs) against machine learning models can lead to serious privacy risks for the training dataset used in the model training. In this paper, we propose a novel and effective Neuron-Guided Defense method named NeuGuard against membership inference attacks (MIAs). We identify a key weakness in existing defense mechanisms against MIAs wherein they cannot simultaneously defend against two commonly used neural network based MIAs, indicating that these two attacks should be separately evaluated to assure the defense effectiveness. We propose NeuGuard, a new defense approach that jointly controls the output and inner neurons' activation with the object to guide the model output of training set and testing set to have close distributions. NeuGuard consists of class-wise variance minimization targeting restricting the final output neurons and layer-wise balanced output control aiming to constrain the inner neurons in each layer. We evaluate NeuGuard and compare it with state-of-the-art defenses against two neural network based MIAs, five strongest metric based MIAs including the newly proposed label-only MIA on three benchmark datasets. Results show that NeuGuard outperforms the state-of-the-art defenses by offering much improved utility-privacy trade-off, generality, and overhead.

A critical problem in post hoc explainability is the lack of a common foundational goal among methods. For example, some methods are motivated by function approximation, some by game theoretic notions, and some by obtaining clean visualizations. This fragmentation of goals causes not only an inconsistent conceptual understanding of explanations but also the practical challenge of not knowing which method to use when. In this work, we begin to address these challenges by unifying eight popular post hoc explanation methods (LIME, C-LIME, SHAP, Occlusion, Vanilla Gradients, Gradients x Input, SmoothGrad, and Integrated Gradients). We show that these methods all perform local function approximation of the black-box model, differing only in the neighbourhood and loss function used to perform the approximation. This unification enables us to (1) state a no free lunch theorem for explanation methods which demonstrates that no single method can perform optimally across all neighbourhoods, and (2) provide a guiding principle to choose among methods based on faithfulness to the black-box model. We empirically validate these theoretical results using various real-world datasets, model classes, and prediction tasks. By bringing diverse explanation methods into a common framework, this work (1) advances the conceptual understanding of these methods, revealing their shared local function approximation objective, properties, and relation to one another, and (2) guides the use of these methods in practice, providing a principled approach to choose among methods and paving the way for the creation of new ones.

Sepsis is a deadly condition affecting many patients in the hospital. Recent studies have shown that patients diagnosed with sepsis have significant mortality and morbidity, resulting from the body's dysfunctional host response to infection. Clinicians often rely on the use of Sequential Organ Failure Assessment (SOFA), Systemic Inflammatory Response Syndrome (SIRS), and the Modified Early Warning Score (MEWS) to identify early signs of clinical deterioration requiring further work-up and treatment. However, many of these tools are manually computed and were not designed for automated computation. There have been different methods used for developing sepsis onset models, but many of these models must be trained on a sufficient number of patient observations in order to form accurate sepsis predictions. Additionally, the accurate annotation of patients with sepsis is a major ongoing challenge. In this paper, we propose the use of Active Learning Recurrent Neural Networks (ALRts) for short temporal horizons to improve the prediction of irregularly sampled temporal events such as sepsis. We show that an active learning RNN model trained on limited data can form robust sepsis predictions comparable to models using the entire training dataset.

Spiking neural networks (SNNs) have attracted much attention for their high energy efficiency and for recent advances in their classification performance. However, unlike traditional deep learning approaches, the analysis and study of the robustness of SNNs to adversarial examples remain relatively underdeveloped. In this work we focus on advancing the adversarial attack side of SNNs and make three major contributions. First, we show that successful white-box adversarial attacks on SNNs are highly dependent on the underlying surrogate gradient technique. Second, using the best surrogate gradient technique, we analyze the transferability of adversarial attacks on SNNs and other state-of-the-art architectures like Vision Transformers (ViTs) and Big Transfer Convolutional Neural Networks (CNNs). We demonstrate that SNNs are not often deceived by adversarial examples generated by Vision Transformers and certain types of CNNs. Third, due to the lack of an ubiquitous white-box attack that is effective across both the SNN and CNN/ViT domains, we develop a new white-box attack, the Auto Self-Attention Gradient Attack (Auto SAGA). Our novel attack generates adversarial examples capable of fooling both SNN models and non-SNN models simultaneously. Auto SAGA is as much as $87.9\%$ more effective on SNN/ViT model ensembles than conventional white-box attacks like PGD. Our experiments and analyses are broad and rigorous covering three datasets (CIFAR-10, CIFAR-100 and ImageNet), five different white-box attacks and nineteen different classifier models (seven for each CIFAR dataset and five different models for ImageNet).

The most useful data mining primitives are distance measures. With an effective distance measure, it is possible to perform classification, clustering, anomaly detection, segmentation, etc. For single-event time series Euclidean Distance and Dynamic Time Warping distance are known to be extremely effective. However, for time series containing cyclical behaviors, the semantic meaningfulness of such comparisons is less clear. For example, on two separate days the telemetry from an athlete workout routine might be very similar. The second day may change the order in of performing push-ups and squats, adding repetitions of pull-ups, or completely omitting dumbbell curls. Any of these minor changes would defeat existing time series distance measures. Some bag-of-features methods have been proposed to address this problem, but we argue that in many cases, similarity is intimately tied to the shapes of subsequences within these longer time series. In such cases, summative features will lack discrimination ability. In this work we introduce PRCIS, which stands for Pattern Representation Comparison in Series. PRCIS is a distance measure for long time series, which exploits recent progress in our ability to summarize time series with dictionaries. We will demonstrate the utility of our ideas on diverse tasks and datasets.

We study a class of dynamical systems modelled as Markov chains that admit an invariant distribution via the corresponding transfer, or Koopman, operator. While data-driven algorithms to reconstruct such operators are well known, their relationship with statistical learning is largely unexplored. We formalize a framework to learn the Koopman operator from finite data trajectories of the dynamical system. We consider the restriction of this operator to a reproducing kernel Hilbert space and introduce a notion of risk, from which different estimators naturally arise. We link the risk with the estimation of the spectral decomposition of the Koopman operator. These observations motivate a reduced-rank operator regression (RRR) estimator. We derive learning bounds for the proposed estimator, holding both in i.i.d. and non i.i.d. settings, the latter in terms of mixing coefficients. Our results suggest RRR might be beneficial over other widely used estimators as confirmed in numerical experiments both for forecasting and mode decomposition.

Motivated by the growing importance of reducing unfairness in ML predictions, Fair-ML researchers have presented an extensive suite of algorithmic 'fairness-enhancing' remedies. Most existing algorithms, however, are agnostic to the sources of the observed unfairness. As a result, the literature currently lacks guiding frameworks to specify conditions under which each algorithmic intervention can potentially alleviate the underpinning cause of unfairness. To close this gap, we scrutinize the underlying biases (e.g., in the training data or design choices) that cause observational unfairness. We present the conceptual idea and a first implementation of a bias-injection sandbox tool to investigate fairness consequences of various biases and assess the effectiveness of algorithmic remedies in the presence of specific types of bias. We call this process the bias(stress)-testing of algorithmic interventions. Unlike existing toolkits, ours provides a controlled environment to counterfactually inject biases in the ML pipeline. This stylized setup offers the distinct capability of testing fairness interventions beyond observational data and against an unbiased benchmark. In particular, we can test whether a given remedy can alleviate the injected bias by comparing the predictions resulting after the intervention in the biased setting with true labels in the unbiased regime-that is, before any bias injection. We illustrate the utility of our toolkit via a proof-of-concept case study on synthetic data. Our empirical analysis showcases the type of insights that can be obtained through our simulations.

An ideal music synthesizer should be both interactive and expressive, generating high-fidelity audio in realtime for arbitrary combinations of instruments and notes. Recent neural synthesizers have exhibited a tradeoff between domain-specific models that offer detailed control of only specific instruments, or raw waveform models that can train on any music but with minimal control and slow generation. In this work, we focus on a middle ground of neural synthesizers that can generate audio from MIDI sequences with arbitrary combinations of instruments in realtime. This enables training on a wide range of transcription datasets with a single model, which in turn offers note-level control of composition and instrumentation across a wide range of instruments. We use a simple two-stage process: MIDI to spectrograms with an encoder-decoder Transformer, then spectrograms to audio with a generative adversarial network (GAN) spectrogram inverter. We compare training the decoder as an autoregressive model and as a Denoising Diffusion Probabilistic Model (DDPM) and find that the DDPM approach is superior both qualitatively and as measured by audio reconstruction and Fr\'echet distance metrics. Given the interactivity and generality of this approach, we find this to be a promising first step towards interactive and expressive neural synthesis for arbitrary combinations of instruments and notes.

To be successful in single source domain generalization, maximizing diversity of synthesized domains has emerged as one of the most effective strategies. Many of the recent successes have come from methods that pre-specify the types of diversity that a model is exposed to during training, so that it can ultimately generalize well to new domains. However, na\"ive diversity based augmentations do not work effectively for domain generalization either because they cannot model large domain shift, or because the span of transforms that are pre-specified do not cover the types of shift commonly occurring in domain generalization. To address this issue, we present a novel framework that uses adversarially learned transformations (ALT) using a neural network to model plausible, yet hard image transformations that fool the classifier. This network is randomly initialized for each batch and trained for a fixed number of steps to maximize classification error. Further, we enforce consistency between the classifier's predictions on the clean and transformed images. With extensive empirical analysis, we find that this new form of adversarial transformations achieve both objectives of diversity and hardness simultaneously, outperforming all existing techniques on competitive benchmarks for single source domain generalization. We also show that ALT can naturally work with existing diversity modules to produce highly distinct, and large transformations of the source domain leading to state-of-the-art performance.

Some of the tightest information-theoretic generalization bounds depend on the average information between the learned hypothesis and a single training example. However, these sample-wise bounds were derived only for expected generalization gap. We show that even for expected squared generalization gap no such sample-wise information-theoretic bounds exist. The same is true for PAC-Bayes and single-draw bounds. Remarkably, PAC-Bayes, single-draw and expected squared generalization gap bounds that depend on information in pairs of examples exist.

There is a significant need for principled uncertainty reasoning in machine learning systems as they are increasingly deployed in safety-critical domains. A new approach with uncertainty-aware regression-based neural networks (NNs), based on learning evidential distributions for aleatoric and epistemic uncertainties, shows promise over traditional deterministic methods and typical Bayesian NNs, notably with the capabilities to disentangle aleatoric and epistemic uncertainties. Despite some empirical success of Deep Evidential Regression (DER), there are important gaps in the mathematical foundation that raise the question of why the proposed technique seemingly works. We detail the theoretical shortcomings and analyze the performance on synthetic and real-world data sets, showing that Deep Evidential Regression is a heuristic rather than an exact uncertainty quantification. We go on to propose corrections and redefinitions of how aleatoric and epistemic uncertainties should be extracted from NNs.

Breast tumor segmentation is one of the key steps that helps us characterize and localize tumor regions. However, variable tumor morphology, blurred boundary, and similar intensity distributions bring challenges for accurate segmentation of breast tumors. Recently, many U-net variants have been proposed and widely used for breast tumors segmentation. However, these architectures suffer from two limitations: (1) Ignoring the characterize ability of the benchmark networks, and (2) Introducing extra complex operations increases the difficulty of understanding and reproducing the network. To alleviate these challenges, this paper proposes a simple yet powerful nested U-net (NU-net) for accurate segmentation of breast tumors. The key idea is to utilize U-Nets with different depths and shared weights to achieve robust characterization of breast tumors. NU-net mainly has the following advantages: (1) Improving network adaptability and robustness to breast tumors with different scales, (2) This method is easy to reproduce and execute, and (3) The extra operations increase network parameters without significantly increasing computational cost. Extensive experimental results with twelve state-of-the-art segmentation methods on three public breast ultrasound datasets demonstrate that NU-net has more competitive segmentation performance on breast tumors. Furthermore, the robustness of NU-net is further illustrated on the segmentation of renal ultrasound images. The source code is publicly available on https://github.com/CGPzy/NU-net.

Sampling is ubiquitous in machine learning methodologies. Due to the growth of large datasets and model complexity, we want to learn and adapt the sampling process while training a representation. Towards achieving this grand goal, a variety of sampling techniques have been proposed. However, most of them either use a fixed sampling scheme or adjust the sampling scheme based on simple heuristics. They cannot choose the best sample for model training in different stages. Inspired by "Think, Fast and Slow" (System 1 and System 2) in cognitive science, we propose a reward-guided sampling strategy called Adaptive Sample with Reward (ASR) to tackle this challenge. To the best of our knowledge, this is the first work utilizing reinforcement learning (RL) to address the sampling problem in representation learning. Our approach optimally adjusts the sampling process to achieve optimal performance. We explore geographical relationships among samples by distance-based sampling to maximize overall cumulative reward. We apply ASR to the long-standing sampling problems in similarity-based loss functions. Empirical results in information retrieval and clustering demonstrate ASR's superb performance across different datasets. We also discuss an engrossing phenomenon which we name as "ASR gravity well" in experiments.

Earthquakes have a deep impact on wide areas, and emergency rescue operations may benefit from social media information about the scope and extent of the disaster. Therefore, this work presents a text miningbased approach to collect and analyze social media data for early earthquake impact analysis. First, disasterrelated microblogs are collected from the Sina microblog based on crawler technology. Then, after data cleaning a series of analyses are conducted including (1) the hot words analysis, (2) the trend of the number of microblogs, (3) the trend of public opinion sentiment, and (4) a keyword and rule-based text classification for earthquake impact analysis. Finally, two recent earthquakes with the same magnitude and focal depth in China are analyzed to compare their impacts. The results show that the public opinion trend analysis and the trend of public opinion sentiment can estimate the earthquake's social impact at an early stage, which will be helpful to decision-making and rescue management.

In this paper, we work on a sound recognition system that continually incorporates new sound classes. Our main goal is to develop a framework where the model can be updated without relying on labeled data. For this purpose, we propose adopting representation learning, where an encoder is trained using unlabeled data. This learning framework enables the study and implementation of a practically relevant use case where only a small amount of the labels is available in a continual learning context. We also make the empirical observation that a similarity-based representation learning method within this framework is robust to forgetting even if no explicit mechanism against forgetting is employed. We show that this approach obtains similar performance compared to several distillation-based continual learning methods when employed on self-supervised representation learning methods.

In this paper, we propose Wasserstein Isometric Mapping (Wassmap), a nonlinear dimensionality reduction technique that provides solutions to some drawbacks in existing global nonlinear dimensionality reduction algorithms in imaging applications. Wassmap represents images via probability measures in Wasserstein space, then uses pairwise Wasserstein distances between the associated measures to produce a low-dimensional, approximately isometric embedding. We show that the algorithm is able to exactly recover parameters of some image manifolds including those generated by translations or dilations of a fixed generating measure. Additionally, we show that a discrete version of the algorithm retrieves parameters from manifolds generated from discrete measures by providing a theoretical bridge to transfer recovery results from functional data to discrete data. Testing of the proposed algorithms on various image data manifolds show that Wassmap yields good embeddings compared with other global and local techniques.

The hydrodynamic performance of a sea-going ship varies over its lifespan due to factors like marine fouling and the condition of the anti-fouling paint system. In order to accurately estimate the power demand and fuel consumption for a planned voyage, it is important to assess the hydrodynamic performance of the ship. The current work uses machine-learning (ML) methods to estimate the hydrodynamic performance of a ship using the onboard recorded in-service data. Three ML methods, NL-PCR, NL-PLSR and probabilistic ANN, are calibrated using the data from two sister ships. The calibrated models are used to extract the varying trend in ship's hydrodynamic performance over time and predict the change in performance through several propeller and hull cleaning events. The predicted change in performance is compared with the corresponding values estimated using the fouling friction coefficient ($\Delta C_F$). The ML methods are found to be performing well while modelling the hydrodynamic state variables of the ships with probabilistic ANN model performing the best, but the results from NL-PCR and NL-PLSR are not far behind, indicating that it may be possible to use simple methods to solve such problems with the help of domain knowledge.

While data-driven predictive models are a strictly technological construct, they may operate within a social context in which benign engineering choices entail implicit, indirect and unexpected real-life consequences. Fairness of such systems -- pertaining both to individuals and groups -- is one relevant consideration in this space; it surfaces when data capture protected characteristics upon which people may be discriminated. To date, this notion has predominantly been studied for a fixed predictive model, often under different classification thresholds, striving to identify and eradicate undesirable, and possibly unlawful, aspects of its operation. Here, we backtrack on this assumption to propose and explore a novel definition of fairness where individuals can be harmed when one predictor is chosen ad hoc from a group of equally-well performing models, i.e., in view of utility-based model multiplicity. Since a person may be classified differently across models that are otherwise considered equivalent, this individual could argue for a predictor with the most favourable outcome, employing which may have adverse effects on others. We introduce this scenario with a two-dimensional example based on linear classification; then, we investigate its analytical properties in a broader context; and, finally, we present experimental results on data sets that are popular in fairness studies. Our findings suggest that such unfairness can be found in real-life situations and may be difficult to mitigate by technical means alone, as doing so degrades certain metrics of predictive performance.

Navigation is one of the most heavily studied problems in robotics, and is conventionally approached as a geometric mapping and planning problem. However, real-world navigation presents a complex set of physical challenges that defies simple geometric abstractions. Machine learning offers a promising way to go beyond geometry and conventional planning, allowing for navigational systems that make decisions based on actual prior experience. Such systems can reason about traversability in ways that go beyond geometry, accounting for the physical outcomes of their actions and exploiting patterns in real-world environments. They can also improve as more data is collected, potentially providing a powerful network effect. In this article, we present a general toolkit for experiential learning of robotic navigation skills that unifies several recent approaches, describe the underlying design principles, summarize experimental results from several of our recent papers, and discuss open problems and directions for future work.

Autonomous vehicle (AV) stacks are typically built in a modular fashion, with explicit components performing detection, tracking, prediction, planning, control, etc. While modularity improves reusability, interpretability, and generalizability, it also suffers from compounding errors, information bottlenecks, and integration challenges. To overcome these challenges, a prominent approach is to convert the AV stack into an end-to-end neural network and train it with data. While such approaches have achieved impressive results, they typically lack interpretability and reusability, and they eschew principled analytical components, such as planning and control, in favor of deep neural networks. To enable the joint optimization of AV stacks while retaining modularity, we present DiffStack, a differentiable and modular stack for prediction, planning, and control. Crucially, our model-based planning and control algorithms leverage recent advancements in differentiable optimization to produce gradients, enabling optimization of upstream components, such as prediction, via backpropagation through planning and control. Our results on the nuScenes dataset indicate that end-to-end training with DiffStack yields substantial improvements in open-loop and closed-loop planning metrics by, e.g., learning to make fewer prediction errors that would affect planning. Beyond these immediate benefits, DiffStack opens up new opportunities for fully data-driven yet modular and interpretable AV architectures. Project website: https://sites.google.com/view/diffstack

We present RAVEn, a self-supervised multi-modal approach to jointly learn visual and auditory speech representations. Our pre-training objective involves encoding masked inputs, and then predicting contextualised targets generated by slowly-evolving momentum encoders. Driven by the inherent differences between video and audio, our design is asymmetric w.r.t. the two modalities' pretext tasks: Whereas the auditory stream predicts both the visual and auditory targets, the visual one predicts only the auditory targets. We observe strong results in low- and high-resource labelled data settings when fine-tuning the visual and auditory encoders resulting from a single pre-training stage, in which the encoders are jointly trained. Notably, RAVEn surpasses all self-supervised methods on visual speech recognition (VSR) on LRS3, and combining RAVEn with self-training using only 30 hours of labelled data even outperforms a recent semi-supervised method trained on 90,000 hours of non-public data. At the same time, we achieve state-of-the-art results in the LRS3 low-resource setting for auditory speech recognition (as well as for VSR). Our findings point to the viability of learning powerful speech representations entirely from raw video and audio, i.e., without relying on handcrafted features. Code and models will be made public.

Multi-player multi-armed bandit is an increasingly relevant decision-making problem, motivated by applications to cognitive radio systems. Most research for this problem focuses exclusively on the settings that players have \textit{full access} to all arms and receive no reward when pulling the same arm. Hence all players solve the same bandit problem with the goal of maximizing their cumulative reward. However, these settings neglect several important factors in many real-world applications, where players have \textit{limited access} to \textit{a dynamic local subset of arms} (i.e., an arm could sometimes be ``walking'' and not accessible to the player). To this end, this paper proposes a \textit{multi-player multi-armed walking bandits} model, aiming to address aforementioned modeling issues. The goal now is to maximize the reward, however, players can only pull arms from the local subset and only collect a full reward if no other players pull the same arm. We adopt Upper Confidence Bound (UCB) to deal with the exploration-exploitation tradeoff and employ distributed optimization techniques to properly handle collisions. By carefully integrating these two techniques, we propose a decentralized algorithm with near-optimal guarantee on the regret, and can be easily implemented to obtain competitive empirical performance.

Evaluating the performance of an ongoing policy plays a vital role in many areas such as medicine and economics, to provide crucial instruction on the early-stop of the online experiment and timely feedback from the environment. Policy evaluation in online learning thus attracts increasing attention by inferring the mean outcome of the optimal policy (i.e., the value) in real-time. Yet, such a problem is particularly challenging due to the dependent data generated in the online environment, the unknown optimal policy, and the complex exploration and exploitation trade-off in the adaptive experiment. In this paper, we aim to overcome these difficulties in policy evaluation for online learning. We explicitly derive the probability of exploration that quantifies the probability of exploring the non-optimal actions under commonly used bandit algorithms. We use this probability to conduct valid inference on the online conditional mean estimator under each action and develop the doubly robust interval estimation (DREAM) method to infer the value under the estimated optimal policy in online learning. The proposed value estimator provides double protection on the consistency and is asymptotically normal with a Wald-type confidence interval provided. Extensive simulations and real data applications are conducted to demonstrate the empirical validity of the proposed DREAM method.

Optimization of directed acyclic graph (DAG) structures has many applications, such as neural architecture search (NAS) and probabilistic graphical model learning. Encoding DAGs into real vectors is a dominant component in most neural-network-based DAG optimization frameworks. Currently, most DAG encoders use an asynchronous message passing scheme which sequentially processes nodes according to the dependency between nodes in a DAG. That is, a node must not be processed until all its predecessors are processed. As a result, they are inherently not parallelizable. In this work, we propose a Parallelizable Attention-based Computation structure Encoder (PACE) that processes nodes simultaneously and encodes DAGs in parallel. We demonstrate the superiority of PACE through encoder-dependent optimization subroutines that search the optimal DAG structure based on the learned DAG embeddings. Experiments show that PACE not only improves the effectiveness over previous sequential DAG encoders with a significantly boosted training and inference speed, but also generates smooth latent (DAG encoding) spaces that are beneficial to downstream optimization subroutines. Our source code is available at \url{https://github.com/zehao-dong/PACE}

Despite the tremendous advances in machine learning (ML), training with imbalanced data still poses challenges in many real-world applications. Among a series of diverse techniques to solve this problem, sampling algorithms are regarded as an efficient solution. However, the problem is more fundamental, with many works emphasizing the importance of instance hardness. This issue refers to the significance of managing unsafe or potentially noisy instances that are more likely to be misclassified and serve as the root cause of poor classification performance. This paper introduces HardVis, a visual analytics system designed to handle instance hardness mainly in imbalanced classification scenarios. Our proposed system assists users in visually comparing different distributions of data types, selecting types of instances based on local characteristics that will later be affected by the active sampling method, and validating which suggestions from undersampling or oversampling techniques are beneficial for the ML model. Additionally, rather than uniformly undersampling/oversampling a specific class, we allow users to find and sample easy and difficult to classify training instances from all classes. Users can explore subsets of data from different perspectives to decide all those parameters, while HardVis keeps track of their steps and evaluates the model's predictive performance in a test set separately. The end result is a well-balanced data set that boosts the predictive power of the ML model. The efficacy and effectiveness of HardVis are demonstrated with a hypothetical usage scenario and a use case. Finally, we also look at how useful our system is based on feedback we received from ML experts.

Discovering new materials is a challenging task in materials science crucial to the progress of human society. Conventional approaches based on experiments and simulations are labor-intensive or costly with success heavily depending on experts' heuristic knowledge. Here, we propose a deep learning based Physics Guided Crystal Generative Model (PGCGM) for efficient crystal material design with high structural diversity and symmetry. Our model increases the generation validity by more than 700\% compared to FTCP, one of the latest structure generators and by more than 45\% compared to our previous CubicGAN model. Density Functional Theory (DFT) calculations are used to validate the generated structures with 1,869 materials out of 2,000 are successfully optimized and deposited into the Carolina Materials Database \url{www.carolinamatdb.org}, of which 39.6\% have negative formation energy and 5.3\% have energy-above-hull less than 0.25 eV/atom, indicating their thermodynamic stability and potential synthesizability.

Although understanding and characterizing causal effects have become essential in observational studies, it is challenging when the confounders are high-dimensional. In this article, we develop a general framework $\textit{CausalEGM}$ for estimating causal effects by encoding generative modeling, which can be applied in both binary and continuous treatment settings. Under the potential outcome framework with unconfoundedness, we establish a bidirectional transformation between the high-dimensional confounders space and a low-dimensional latent space where the density is known (e.g., multivariate normal distribution). Through this, CausalEGM simultaneously decouples the dependencies of confounders on both treatment and outcome and maps the confounders to the low-dimensional latent space. By conditioning on the low-dimensional latent features, CausalEGM can estimate the causal effect for each individual or the average causal effect within a population. Our theoretical analysis shows that the excess risk for CausalEGM can be bounded through empirical process theory. Under an assumption on encoder-decoder networks, the consistency of the estimate can be guaranteed. In a series of experiments, CausalEGM demonstrates superior performance over existing methods for both binary and continuous treatments. Specifically, we find CausalEGM to be substantially more powerful than competing methods in the presence of large sample sizes and high dimensional confounders. The software of CausalEGM is freely available at https://github.com/SUwonglab/CausalEGM.

In this work, we consider the problem of learning a feed-forward neural network controller to safely steer an arbitrarily shaped planar robot in a compact and obstacle-occluded workspace. Unlike existing methods that depend strongly on the density of data points close to the boundary of the safe state space to train neural network controllers with closed-loop safety guarantees, here we propose an alternative approach that lifts such strong assumptions on the data that are hard to satisfy in practice and instead allows for graceful safety violations, i.e., of a bounded magnitude that can be spatially controlled. To do so, we employ reachability analysis techniques to encapsulate safety constraints in the training process. Specifically, to obtain a computationally efficient over-approximation of the forward reachable set of the closed-loop system, we partition the robot's state space into cells and adaptively subdivide the cells that contain states which may escape the safe set under the trained control law. Then, using the overlap between each cell's forward reachable set and the set of infeasible robot configurations as a measure for safety violations, we introduce appropriate terms into the loss function that penalize this overlap in the training process. As a result, our method can learn a safe vector field for the closed-loop system and, at the same time, provide worst-case bounds on safety violation over the whole configuration space, defined by the overlap between the over-approximation of the forward reachable set of the closed-loop system and the set of unsafe states. Moreover, it can control the tradeoff between computational complexity and tightness of these bounds. Our proposed method is supported by both theoretical results and simulation studies.

Online advertising has recently grown into a highly competitive and complex multi-billion-dollar industry, with advertisers bidding for ad slots at large scales and high frequencies. This has resulted in a growing need for efficient "auto-bidding" algorithms that determine the bids for incoming queries to maximize advertisers' targets subject to their specified constraints. This work explores efficient online algorithms for a single value-maximizing advertiser under an increasingly popular constraint: Return-on-Spend (RoS). We quantify efficiency in terms of regret relative to the optimal algorithm, which knows all queries a priori. We contribute a simple online algorithm that achieves near-optimal regret in expectation while always respecting the specified RoS constraint when the input sequence of queries are i.i.d. samples from some distribution. We also integrate our results with the previous work of Balseiro, Lu, and Mirrokni [BLM20] to achieve near-optimal regret while respecting both RoS and fixed budget constraints. Our algorithm follows the primal-dual framework and uses online mirror descent (OMD) for the dual updates. However, we need to use a non-canonical setup of OMD, and therefore the classic low-regret guarantee of OMD, which is for the adversarial setting in online learning, no longer holds. Nonetheless, in our case and more generally where low-regret dynamics are applied in algorithm design, the gradients encountered by OMD can be far from adversarial but influenced by our algorithmic choices. We exploit this key insight to show our OMD setup achieves low regret in the realm of our algorithm.

Hyperparameter optimization (HPO) is essential for the better performance of deep learning, and practitioners often need to consider the trade-off between multiple metrics, such as error rate, latency, memory requirements, robustness, and algorithmic fairness. Due to this demand and the heavy computation of deep learning, the acceleration of multi-objective (MO) optimization becomes ever more important. Although meta-learning has been extensively studied to speedup HPO, existing methods are not applicable to the MO tree-structured parzen estimator (MO-TPE), a simple yet powerful MO-HPO algorithm. In this paper, we extend TPE's acquisition function to the meta-learning setting, using a task similarity defined by the overlap in promising domains of each task. In a comprehensive set of experiments, we demonstrate that our method accelerates MO-TPE on tabular HPO benchmarks and yields state-of-the-art performance. Our method was also validated externally by winning the AutoML 2022 competition on "Multiobjective Hyperparameter Optimization for Transformers".

Event cameras are novel bio-inspired sensors that measure per-pixel brightness differences asynchronously. Recovering brightness from events is appealing since the reconstructed images inherit the high dynamic range (HDR) and high-speed properties of events; hence they can be used in many robotic vision applications and to generate slow-motion HDR videos. However, state-of-the-art methods tackle this problem by training an event-to-image Recurrent Neural Network (RNN), which lacks explainability and is difficult to tune. In this work we show, for the first time, how tackling the combined problem of motion and brightness estimation leads us to formulate event-based image reconstruction as a linear inverse problem that can be solved without training an image reconstruction RNN. Instead, classical and learning-based regularizers are used to solve the problem and remove artifacts from the reconstructed images. The experiments show that the proposed approach generates images with visual quality on par with state-of-the-art methods despite only using data from a short time interval. State-of-the-art results are achieved using an image denoising Convolutional Neural Network (CNN) as the regularization function. The proposed regularized formulation and solvers have a unifying character because they can be applied also to reconstruct brightness from the second derivative. Additionally, the formulation is attractive because it can be naturally combined with super-resolution, motion-segmentation and color demosaicing. Code is available at https://github.com/tub-rip/event_based_image_rec_inverse_problem

The sparse representation of graphs has shown its great potential for accelerating the computation of graph applications (e.g., Social Networks, Knowledge Graphs) on traditional computing architectures (CPU, GPU, or TPU). But the exploration of large-scale sparse graph computing on processing-in-memory (PIM) platforms (typically with memristive crossbars) is still in its infancy. To implement the computation or storage of large-scale or batch graphs on memristive crossbars, a natural assumption is that a large-scale crossbar is demanded, but with low utilization. Some recent works question this assumption, to avoid the waste of storage and computational resource, the fixed-size or progressively scheduled ``block partition'' schemes are proposed. But these methods are coarse-grained or static, and are not effectively sparsity-aware. This work proposes the dynamic sparsity-aware mapping scheme generating method that models the problem as a sequential decision-making problem which is optimized by reinforcement learning (RL) algorithm (REINFORCE). Our generating model (LSTM, combined with the dynamic-fill mechanism) generates remarkable mapping performance on a small-scale typical graph/matrix data (complete mapping costs 43% area of the original matrix) and two large-scale matrix data (costing 22.5% area on qh882 and 17.1% area on qh1484). Our method may be extended to sparse graph computing on other PIM architectures, not limited to the memristive device-based platforms.

Many real-world problems are inherently multimodal, from the communicative modalities humans use to express social and emotional states to the force, proprioception, and visual sensors ubiquitous on robots. While there has been an explosion of interest in multimodal representation learning, these methods are still largely focused on a small set of modalities, primarily in the language, vision, and audio space. In order to accelerate generalization towards diverse and understudied modalities, this paper studies efficient representation learning for high-modality scenarios. Since adding new models for every new modality or task becomes prohibitively expensive, a critical technical challenge is heterogeneity quantification: how can we measure which modalities encode similar information and interactions in order to permit parameter sharing with previous modalities? We propose two new information-theoretic metrics for heterogeneity quantification: (1) modality heterogeneity studies how similar 2 modalities $\{X_1,X_2\}$ are by measuring how much information can be transferred from $X_1$ to $X_2$, while (2) interaction heterogeneity studies how similarly pairs of modalities $\{X_1,X_2\}, \{X_3,X_4\}$ interact by measuring how much interaction information can be transferred from $\{X_1,X_2\}$ to $\{X_3,X_4\}$. We show the importance of these proposed metrics in high-modality scenarios as a way to automatically prioritize the fusion of modalities that contain unique information or interactions. The result is a single model, HighMMT, that scales up to $10$ modalities and $15$ tasks from $5$ different research areas. Not only does HighMMT outperform prior methods on the tradeoff between performance and efficiency, it also demonstrates a crucial scaling behavior: performance continues to improve with each modality added, and transfers to entirely new modalities and tasks during fine-tuning.

A recent line of work has shown remarkable behaviors of the generalization error curves in simple learning models. Even the least-squares regression has shown atypical features such as the model-wise double descent, and further works have observed triple or multiple descents. Another important characteristic are the epoch-wise descent structures which emerge during training. The observations of model-wise and epoch-wise descents have been analytically derived in limited theoretical settings (such as the random feature model) and are otherwise experimental. In this work, we provide a full and unified analysis of the whole time-evolution of the generalization curve, in the asymptotic large-dimensional regime and under gradient-flow, within a wider theoretical setting stemming from a gaussian covariate model. In particular, we cover most cases already disparately observed in the literature, and also provide examples of the existence of multiple descent structures as a function of a model parameter or time. Furthermore, we show that our theoretical predictions adequately match the learning curves obtained by gradient descent over realistic datasets. Technically we compute averages of rational expressions involving random matrices using recent developments in random matrix theory based on "linear pencils". Another contribution, which is also of independent interest in random matrix theory, is a new derivation of related fixed point equations (and an extension there-off) using Dyson brownian motions.

The problem of answering questions using knowledge from pre-trained language models (LMs) and knowledge graphs (KGs) presents two challenges: given a QA context (question and answer choice), methods need to (i) identify relevant knowledge from large KGs, and (ii) perform joint reasoning over the QA context and KG. In this work, we propose a new model, QA-GNN, which addresses the above challenges through two key innovations: (i) relevance scoring, where we use LMs to estimate the importance of KG nodes relative to the given QA context, and (ii) joint reasoning, where we connect the QA context and KG to form a joint graph, and mutually update their representations through graph neural networks. We evaluate our model on QA benchmarks in the commonsense (CommonsenseQA, OpenBookQA) and biomedical (MedQA-USMLE) domains. QA-GNN outperforms existing LM and LM+KG models, and exhibits capabilities to perform interpretable and structured reasoning, e.g., correctly handling negation in questions.

Today, recommender systems have played an increasingly important role in shaping our experiences of digital environments and social interactions. However, as recommender systems become ubiquitous in our society, recent years have also witnessed significant fairness concerns for recommender systems. Specifically, studies have shown that recommender systems may inherit or even amplify biases from historical data, and as a result, provide unfair recommendations. To address fairness risks in recommender systems, most of the previous approaches to date are focused on modifying either the existing training data samples or the deployed recommender algorithms, but unfortunately with limited degrees of success. In this paper, we propose a new approach called fair recommendation with optimized antidote data (FairRoad), which aims to improve the fairness performances of recommender systems through the construction of a small and carefully crafted antidote dataset. Toward this end, we formulate our antidote data generation task as a mathematical optimization problem, which minimizes the unfairness of the targeted recommender systems while not disrupting the deployed recommendation algorithms. Extensive experiments show that our proposed antidote data generation algorithm significantly improve the fairness of recommender systems with a small amounts of antidote data.

Leveraging well-established MCMC strategies, we propose MCMC-interactive variational inference (MIVI) to not only estimate the posterior in a time constrained manner, but also facilitate the design of MCMC transitions. Constructing a variational distribution followed by a short Markov chain that has parameters to learn, MIVI takes advantage of the complementary properties of variational inference and MCMC to encourage mutual improvement. On one hand, with the variational distribution locating high posterior density regions, the Markov chain is optimized within the variational inference framework to efficiently target the posterior despite a small number of transitions. On the other hand, the optimized Markov chain with considerable flexibility guides the variational distribution towards the posterior and alleviates its underestimation of uncertainty. Furthermore, we prove the optimized Markov chain in MIVI admits extrapolation, which means its marginal distribution gets closer to the true posterior as the chain grows. Therefore, the Markov chain can be used separately as an efficient MCMC scheme. Experiments show that MIVI not only accurately and efficiently approximates the posteriors but also facilitates designs of stochastic gradient MCMC and Gibbs sampling transitions.

Knowledge graphs contain rich knowledge about various entities and the relational information among them, while temporal knowledge graphs (TKGs) describe and model the interactions of the entities over time. In this context, automatic temporal knowledge graph completion (TKGC) has gained great interest. Recent TKGC methods integrate advanced deep learning techniques, e.g., Transformers, and achieve superior model performance. However, this also introduces a large number of excessive parameters, which brings a heavier burden for parameter optimization. In this paper, we propose a simple but powerful graph encoder for TKGC, called TARGCN. TARGCN is parameter-efficient, and it extensively explores every entity's temporal context for learning contextualized representations. We find that instead of adopting various kinds of complex modules, it is more beneficial to efficiently capture the temporal contexts of entities. We experiment TARGCN on three benchmark datasets. Our model can achieve a more than 46% relative improvement on the GDELT dataset compared with state-of-the-art TKGC models. Meanwhile, it outperforms the strongest baseline on the ICEWS05-15 dataset with around 18% fewer parameters.

Convolutional Neural Networks (CNNs) with U-shaped architectures have dominated medical image segmentation, which is crucial for various clinical purposes. However, the inherent locality of convolution makes CNNs fail to fully exploit global context, essential for better recognition of some structures, e.g., brain lesions. Transformers have recently proven promising performance on vision tasks, including semantic segmentation, mainly due to their capability of modeling long-range dependencies. Nevertheless, the quadratic complexity of attention makes existing Transformer-based models use self-attention layers only after somehow reducing the image resolution, which limits the ability to capture global contexts present at higher resolutions. Therefore, this work introduces a family of models, dubbed Factorizer, which leverages the power of low-rank matrix factorization for constructing an end-to-end segmentation model. Specifically, we propose a linearly scalable approach to context modeling, formulating Nonnegative Matrix Factorization (NMF) as a differentiable layer integrated into a U-shaped architecture. The shifted window technique is also utilized in combination with NMF to effectively aggregate local information. Factorizers compete favorably with CNNs and Transformers in terms of accuracy, scalability, and interpretability, achieving state-of-the-art results on the BraTS dataset for brain tumor segmentation and ISLES'22 dataset for stroke lesion segmentation. Highly meaningful NMF components give an additional interpretability advantage to Factorizers over CNNs and Transformers. Moreover, our ablation studies reveal a distinctive feature of Factorizers that enables a significant speed-up in inference for a trained Factorizer without any extra steps and without sacrificing much accuracy. The code and models are publicly available at https://github.com/pashtari/factorizer.

In consequential decision-making applications, mitigating unwanted biases in machine learning models that yield systematic disadvantage to members of groups delineated by sensitive attributes such as race and gender is one key intervention to strive for equity. Focusing on demographic parity and equality of opportunity, in this paper we propose an algorithm that improves the fairness of a pre-trained classifier by simply dropping carefully selected training data points. We select instances based on their influence on the fairness metric of interest, computed using an infinitesimal jackknife-based approach. The dropping of training points is done in principle, but in practice does not require the model to be refit. Crucially, we find that such an intervention does not substantially reduce the predictive performance of the model but drastically improves the fairness metric. Through careful experiments, we evaluate the effectiveness of the proposed approach on diverse tasks and find that it consistently improves upon existing alternatives.

By transferring knowledge from large, diverse, task-agnostic datasets, modern machine learning models can solve specific downstream tasks either zero-shot or with small task-specific datasets to a high level of performance. While this capability has been demonstrated in other fields such as computer vision, natural language processing or speech recognition, it remains to be shown in robotics, where the generalization capabilities of the models are particularly critical due to the difficulty of collecting real-world robotic data. We argue that one of the keys to the success of such general robotic models lies with open-ended task-agnostic training, combined with high-capacity architectures that can absorb all of the diverse, robotic data. In this paper, we present a model class, dubbed Robotics Transformer, that exhibits promising scalable model properties. We verify our conclusions in a study of different model classes and their ability to generalize as a function of the data size, model size, and data diversity based on a large-scale data collection on real robots performing real-world tasks. The project's website and videos can be found at robotics-transformer.github.io

Software engineers working with the same programming language (PL) may speak different natural languages (NLs) and vice versa, erecting huge barriers to communication and working efficiency. Recent studies have demonstrated the effectiveness of generative pre-training in computer programs, yet they are always English-centric. In this work, we step towards bridging the gap between multilingual NLs and multilingual PLs for large language models (LLMs). We release ERNIE-Code, a unified pre-trained language model for 116 NLs and 6 PLs. We employ two methods for universal cross-lingual pre-training: span-corruption language modeling that learns patterns from monolingual NL or PL; and pivot-based translation language modeling that relies on parallel data of many NLs and PLs. Extensive results show that ERNIE-Code outperforms previous multilingual LLMs for PL or NL across a wide range of end tasks of code intelligence, including multilingual code-to-text, text-to-code, code-to-code, and text-to-text generation. We further show its advantage of zero-shot prompting on multilingual code summarization and text-to-text translation. We will make our code and pre-trained models publicly available.

The automated machine learning (AutoML) field has become increasingly relevant in recent years. These algorithms can develop models without the need for expert knowledge, facilitating the application of machine learning techniques in the industry. Neural Architecture Search (NAS) exploits deep learning techniques to autonomously produce neural network architectures whose results rival the state-of-the-art models hand-crafted by AI experts. However, this approach requires significant computational resources and hardware investments, making it less appealing for real-usage applications. This article presents the third version of Pareto-Optimal Progressive Neural Architecture Search (POPNASv3), a new sequential model-based optimization NAS algorithm targeting different hardware environments and multiple classification tasks. Our method is able to find competitive architectures within large search spaces, while keeping a flexible structure and data processing pipeline to adapt to different tasks. The algorithm employs Pareto optimality to reduce the number of architectures sampled during the search, drastically improving the time efficiency without loss in accuracy. The experiments performed on images and time series classification datasets provide evidence that POPNASv3 can explore a large set of assorted operators and converge to optimal architectures suited for the type of data provided under different scenarios.

Continuous long-term monitoring of motor health is crucial for the early detection of abnormalities such as bearing faults (up to 51% of motor failures are attributed to bearing faults). Despite numerous methodologies proposed for bearing fault detection, most of them require normal (healthy) and abnormal (faulty) data for training. Even with the recent deep learning (DL) methodologies trained on the labeled data from the same machine, the classification accuracy significantly deteriorates when one or few conditions are altered. Furthermore, their performance suffers significantly or may entirely fail when they are tested on another machine with entirely different healthy and faulty signal patterns. To address this need, in this pilot study, we propose a zero-shot bearing fault detection method that can detect any fault on a new (target) machine regardless of the working conditions, sensor parameters, or fault characteristics. To accomplish this objective, a 1D Operational Generative Adversarial Network (Op-GAN) first characterizes the transition between normal and fault vibration signals of (a) source machine(s) under various conditions, sensor parameters, and fault types. Then for a target machine, the potential faulty signals can be generated, and over its actual healthy and synthesized faulty signals, a compact, and lightweight 1D Self-ONN fault detector can then be trained to detect the real faulty condition in real time whenever it occurs. To validate the proposed approach, a new benchmark dataset is created using two different motors working under different conditions and sensor locations. Experimental results demonstrate that this novel approach can accurately detect any bearing fault achieving an average recall rate of around 89% and 95% on two target machines regardless of its type, severity, and location.

Accurate PhotoVoltaic (PV) power generation forecasting is vital for the efficient operation of Smart Grids. The automated design of such accurate forecasting models for individual PV plants includes two challenges: First, information about the PV mounting configuration (i.e. inclination and azimuth angles) is often missing. Second, for new PV plants, the amount of historical data available to train a forecasting model is limited (cold-start problem). We address these two challenges by proposing a new method for day-ahead PV power generation forecasts called AutoPV. AutoPV is a weighted ensemble of forecasting models that represent different PV mounting configurations. This representation is achieved by pre-training each forecasting model on a separate PV plant and by scaling the model's output with the peak power rating of the corresponding PV plant. To tackle the cold-start problem, we initially weight each forecasting model in the ensemble equally. To tackle the problem of missing information about the PV mounting configuration, we use new data that become available during operation to adapt the ensemble weights to minimize the forecasting error. AutoPV is advantageous as the unknown PV mounting configuration is implicitly reflected in the ensemble weights, and only the PV plant's peak power rating is required to re-scale the ensemble's output. AutoPV also allows to represent PV plants with panels distributed on different roofs with varying alignments, as these mounting configurations can be reflected proportionally in the weighting. Additionally, the required computing memory is decoupled when scaling AutoPV to hundreds of PV plants, which is beneficial in Smart Grids with limited computing capabilities. For a real-world data set with 11 PV plants, the accuracy of AutoPV is comparable to a model trained on two years of data and outperforms an incrementally trained model.

Transformers are responsible for the vast majority of recent advances in natural language processing. The majority of practical natural language processing applications of these models are typically enabled through transfer learning. This paper studies if corpus-specific tokenization used for fine-tuning improves the resulting performance of the model. Through a series of experiments, we demonstrate that such tokenization combined with the initialization and fine-tuning strategy for the vocabulary tokens speeds up the transfer and boosts the performance of the fine-tuned model. We call this aspect of transfer facilitation vocabulary transfer.

In time series forecasting, decomposition-based algorithms break aggregate data into meaningful components and are therefore appreciated for their particular advantages in interpretability. Recent algorithms often combine machine learning (hereafter ML) methodology with decomposition to improve prediction accuracy. However, incorporating ML is generally considered to sacrifice interpretability inevitably. In addition, existing hybrid algorithms usually rely on theoretical models with statistical assumptions and focus only on the accuracy of aggregate predictions, and thus suffer from accuracy problems, especially in component estimates. In response to the above issues, this research explores the possibility of improving accuracy without losing interpretability in time series forecasting. We first quantitatively define interpretability for data-driven forecasts and systematically review the existing forecasting algorithms from the perspective of interpretability. Accordingly, we propose the W-R algorithm, a hybrid algorithm that combines decomposition and ML from a novel perspective. Specifically, the W-R algorithm replaces the standard additive combination function with a weighted variant and uses ML to modify the estimates of all components simultaneously. We mathematically analyze the theoretical basis of the algorithm and validate its performance through extensive numerical experiments. In general, the W-R algorithm outperforms all decomposition-based and ML benchmarks. Based on P50_QL, the algorithm relatively improves by 8.76% in accuracy on the practical sales forecasts of JD.com and 77.99% on a public dataset of electricity loads. This research offers an innovative perspective to combine the statistical and ML algorithms, and JD.com has implemented the W-R algorithm to make accurate sales predictions and guide its marketing activities.

State-of-the-art image and text classification models, such as Convectional Neural Networks and Transformers, have long been able to classify their respective unimodal reasoning satisfactorily with accuracy close to or exceeding human accuracy. However, images embedded with text, such as hateful memes, are hard to classify using unimodal reasoning when difficult examples, such as benign confounders, are incorporated into the data set. We attempt to generate more labeled memes in addition to the Hateful Memes data set from Facebook AI, based on the framework of a winning team from the Hateful Meme Challenge. To increase the number of labeled memes, we explore semi-supervised learning using pseudo-labels for newly introduced, unlabeled memes gathered from the Memotion Dataset 7K. We find that the semi-supervised learning task on unlabeled data required human intervention and filtering and that adding a limited amount of new data yields no extra classification performance.

Patch-based models, e.g., Vision Transformers (ViTs) and Mixers, have shown impressive results on various visual recognition tasks, alternating classic convolutional networks. While the initial patch-based models (ViTs) treated all patches equally, recent studies reveal that incorporating inductive bias like spatiality benefits the representations. However, most prior works solely focused on the location of patches, overlooking the scene structure of images. Thus, we aim to further guide the interaction of patches using the object information. Specifically, we propose OAMixer (object-aware mixing layer), which calibrates the patch mixing layers of patch-based models based on the object labels. Here, we obtain the object labels in unsupervised or weakly-supervised manners, i.e., no additional human-annotating cost is necessary. Using the object labels, OAMixer computes a reweighting mask with a learnable scale parameter that intensifies the interaction of patches containing similar objects and applies the mask to the patch mixing layers. By learning an object-centric representation, we demonstrate that OAMixer improves the classification accuracy and background robustness of various patch-based models, including ViTs, MLP-Mixers, and ConvMixers. Moreover, we show that OAMixer enhances various downstream tasks, including large-scale classification, self-supervised learning, and multi-object recognition, verifying the generic applicability of OAMixer

The development and adoption of artificial intelligence (AI) technologies in space applications is growing quickly as the consensus increases on the potential benefits introduced. As more and more aerospace engineers are becoming aware of new trends in AI, traditional approaches are revisited to consider the applications of emerging AI technologies. Already at the time of writing, the scope of AI-related activities across academia, the aerospace industry and space agencies is so wide that an in-depth review would not fit in these pages. In this chapter we focus instead on two main emerging trends we believe capture the most relevant and exciting activities in the field: differentiable intelligence and on-board machine learning. Differentiable intelligence, in a nutshell, refers to works making extensive use of automatic differentiation frameworks to learn the parameters of machine learning or related models. Onboard machine learning considers the problem of moving inference, as well as learning, onboard. Within these fields, we discuss a few selected projects originating from the European Space Agency's (ESA) Advanced Concepts Team (ACT), giving priority to advanced topics going beyond the transposition of established AI techniques and practices to the space domain.

Existing deep learning-based traffic forecasting models are mainly trained with MSE (or MAE) as the loss function, assuming that residuals/errors follow independent and isotropic Gaussian (or Laplacian) distribution for simplicity. However, this assumption rarely holds for real-world traffic forecasting tasks, where the unexplained residuals are often correlated in both space and time. In this study, we propose Spatiotemporal Residual Regularization by modeling residuals with a dynamic (e.g., time-varying) mixture of zero-mean multivariate Gaussian distribution with learnable spatiotemporal covariance matrices. This approach allows us to directly capture spatiotemporally correlated residuals. For scalability, we model the spatiotemporal covariance for each mixture component using a Kronecker product structure, which significantly reduces the number of parameters and computation complexity. We evaluate the performance of the proposed method on a traffic speed forecasting task. Our results show that, by properly modeling residual distribution, the proposed method not only improves the model performance but also provides interpretable structures.

In this paper, we study the effect of a novel regularization scheme on contrastive language-image pre-trained (CLIP) models. Our approach is based on the observation that, in many domains, text tokens should only describe a small number of image regions and, likewise, each image region should correspond to only a few text tokens. In CLIP-style models, this implies that text-token embeddings should have high similarity to only a small number of image-patch embeddings for a given image-text pair. We formalize this observation using a novel regularization scheme that penalizes the entropy of the text-token to image-patch similarity scores. We qualitatively and quantitatively demonstrate that the proposed regularization scheme shrinks the text-token and image-patch similarity scores towards zero, thus achieving the desired effect. We demonstrate the promise of our approach in an important medical context where this underlying hypothesis naturally arises. Using our proposed approach, we achieve state of the art (SOTA) zero-shot performance on all tasks from the CheXpert chest x-ray dataset, outperforming an unregularized version of the model and several recently published self-supervised models.

The dissemination of hateful memes online has adverse effects on social media platforms and the real world. Detecting hateful memes is challenging, one of the reasons being the evolutionary nature of memes; new hateful memes can emerge by fusing hateful connotations with other cultural ideas or symbols. In this paper, we propose a framework that leverages multimodal contrastive learning models, in particular OpenAI's CLIP, to identify targets of hateful content and systematically investigate the evolution of hateful memes. We find that semantic regularities exist in CLIP-generated embeddings that describe semantic relationships within the same modality (images) or across modalities (images and text). Leveraging this property, we study how hateful memes are created by combining visual elements from multiple images or fusing textual information with a hateful image. We demonstrate the capabilities of our framework for analyzing the evolution of hateful memes by focusing on antisemitic memes, particularly the Happy Merchant meme. Using our framework on a dataset extracted from 4chan, we find 3.3K variants of the Happy Merchant meme, with some linked to specific countries, persons, or organizations. We envision that our framework can be used to aid human moderators by flagging new variants of hateful memes so that moderators can manually verify them and mitigate the problem of hateful content online.

Both clustering and outlier detection play an important role for meteorological measurements. We present the AWT algorithm, a clustering algorithm for time series data that also performs implicit outlier detection during the clustering. AWT integrates ideas of several well-known K-Means clustering algorithms. It chooses the number of clusters automatically based on a user-defined threshold parameter, and it can be used for heterogeneous meteorological input data as well as for data sets that exceed the available memory size. We apply AWT to crowd sourced 2-m temperature data with an hourly resolution from the city of Vienna to detect outliers and to investigate if the final clusters show general similarities and similarities with urban land-use characteristics. It is shown that both the outlier detection and the implicit mapping to land-use characteristic is possible with AWT which opens new possible fields of application, specifically in the rapidly evolving field of urban climate and urban weather.

This research revisits the classic Turing test and compares recent large language models such as ChatGPT for their abilities to reproduce human-level comprehension and compelling text generation. Two task challenges -- summarization, and question answering -- prompt ChatGPT to produce original content (98-99%) from a single text entry and also sequential questions originally posed by Turing in 1950. The question of a machine fooling a human judge recedes in this work relative to the question of "how would one prove it?" The original contribution of the work presents a metric and simple grammatical set for understanding the writing mechanics of chatbots in evaluating their readability and statistical clarity, engagement, delivery, and overall quality. While Turing's original prose scores at least 14% below the machine-generated output, the question of whether an algorithm displays hints of Turing's truly original thoughts (the "Lovelace 2.0" test) remains unanswered and potentially unanswerable for now.

Sunquakes are seismic emissions visible on the solar surface, associated with some solar flares. Although discovered in 1998, they have only recently become a more commonly detected phenomenon. Despite the availability of several manual detection guidelines, to our knowledge, the astrophysical data produced for sunquakes is new to the field of Machine Learning. Detecting sunquakes is a daunting task for human operators and this work aims to ease and, if possible, to improve their detection. Thus, we introduce a dataset constructed from acoustic egression-power maps of solar active regions obtained for Solar Cycles 23 and 24 using the holography method. We then present a pedagogical approach to the application of machine learning representation methods for sunquake detection using AutoEncoders, Contrastive Learning, Object Detection and recurrent techniques, which we enhance by introducing several custom domain-specific data augmentation transformations. We address the main challenges of the automated sunquake detection task, namely the very high noise patterns in and outside the active region shadow and the extreme class imbalance given by the limited number of frames that present sunquake signatures. With our trained models, we find temporal and spatial locations of peculiar acoustic emission and qualitatively associate them to eruptive and high energy emission. While noting that these models are still in a prototype stage and there is much room for improvement in metrics and bias levels, we hypothesize that their agreement on example use cases has the potential to enable detection of weak solar acoustic manifestations.

Semantic communication (SemCom) and edge computing are two disruptive solutions to address emerging requirements of huge data communication, bandwidth efficiency and low latency data processing in Metaverse. However, edge computing resources are often provided by computing service providers and thus it is essential to design appealingly incentive mechanisms for the provision of limited resources. Deep learning (DL)- based auction has recently proposed as an incentive mechanism that maximizes the revenue while holding important economic properties, i.e., individual rationality and incentive compatibility. Therefore, in this work, we introduce the design of the DLbased auction for the computing resource allocation in SemComenabled Metaverse. First, we briefly introduce the fundamentals and challenges of Metaverse. Second, we present the preliminaries of SemCom and edge computing. Third, we review various incentive mechanisms for edge computing resource trading. Fourth, we present the design of the DL-based auction for edge resource allocation in SemCom-enabled Metaverse. Simulation results demonstrate that the DL-based auction improves the revenue while nearly satisfying the individual rationality and incentive compatibility constraints.

Climate change, population growth, and water scarcity present unprecedented challenges for agriculture. This project aims to forecast soil moisture using domain knowledge and machine learning for crop management decisions that enable sustainable farming. Traditional methods for predicting hydrological response features require significant computational time and expertise. Recent work has implemented machine learning models as a tool for forecasting hydrological response features, but these models neglect a crucial component of traditional hydrological modeling that spatially close units can have vastly different hydrological responses. In traditional hydrological modeling, units with similar hydrological properties are grouped together and share model parameters regardless of their spatial proximity. Inspired by this domain knowledge, we have constructed a novel domain-inspired temporal graph convolution neural network. Our approach involves clustering units based on time-varying hydrological properties, constructing graph topologies for each cluster, and forecasting soil moisture using graph convolutions and a gated recurrent neural network. We have trained, validated, and tested our method on field-scale time series data consisting of approximately 99,000 hydrological response units spanning 40 years in a case study in northeastern United States. Comparison with existing models illustrates the effectiveness of using domain-inspired clustering with time series graph neural networks. The framework is being deployed as part of a pro bono social impact program. The trained models are being deployed on small-holding farms in central Texas.

Many speech applications require understanding aspects beyond the words being spoken, such as recognizing emotion, detecting whether the speaker is wearing a mask, or distinguishing real from synthetic speech. In this work, we introduce a new state-of-the-art paralinguistic representation derived from large-scale, fully self-supervised training of a 600M+ parameter Conformer-based architecture. We benchmark on a diverse set of speech tasks and demonstrate that simple linear classifiers trained on top of our time-averaged representation outperform nearly all previous results, in some cases by large margins. Our analyses of context-window size demonstrate that, surprisingly, 2 second context-windows achieve 96\% the performance of the Conformers that use the full long-term context on 7 out of 9 tasks. Furthermore, while the best per-task representations are extracted internally in the network, stable performance across several layers allows a single universal representation to reach near optimal performance on all tasks.

Molecular dynamics (MD) has long been the de facto choice for simulating complex atomistic systems from first principles. Recently deep learning models become a popular way to accelerate MD. Notwithstanding, existing models depend on intermediate variables such as the potential energy or force fields to update atomic positions, which requires additional computations to perform back-propagation. To waive this requirement, we propose a novel model called DiffMD by directly estimating the gradient of the log density of molecular conformations. DiffMD relies on a score-based denoising diffusion generative model that perturbs the molecular structure with a conditional noise depending on atomic accelerations and treats conformations at previous timeframes as the prior distribution for sampling. Another challenge of modeling such a conformation generation process is that a molecule is kinetic instead of static, which no prior works have strictly studied. To solve this challenge, we propose an equivariant geometric Transformer as the score function in the diffusion process to calculate corresponding gradients. It incorporates the directions and velocities of atomic motions via 3D spherical Fourier-Bessel representations. With multiple architectural improvements, we outperform state-of-the-art baselines on MD17 and isomers of C7O2H10 datasets. This work contributes to accelerating material and drug discovery.

We study short-term prediction of wind speed and wind power (every 10 minutes up to 4 hours ahead). Accurate forecasts for these quantities are crucial to mitigate the negative effects of wind farms' intermittent production on energy systems and markets. We use machine learning to combine outputs from numerical weather prediction models with local observations. The former provide valuable information on higher scales dynamics while the latter gives the model fresher and location-specific data. So as to make the results usable for practitioners, we focus on well-known methods which can handle a high volume of data. We study first variable selection using both a linear technique and a nonlinear one. Then we exploit these results to forecast wind speed and wind power still with an emphasis on linear models versus nonlinear ones. For the wind power prediction, we also compare the indirect approach (wind speed predictions passed through a power curve) and the indirect one (directly predict wind power).

Generating power system states that have similar distribution and dependency to the historical ones is essential for the tasks of system planning and security assessment, especially when the historical data is insufficient. In this paper, we described a generative model for load profiles of industrial and commercial customers, based on the conditional variational autoencoder (CVAE) neural network architecture, which is challenging due to the highly variable nature of such profiles. Generated contextual load profiles were conditioned on the month of the year and typical power exchange with the grid. Moreover, the quality of generations was both visually and statistically evaluated. The experimental results demonstrate our proposed CVAE model can capture temporal features of historical load profiles and generate `realistic' data with satisfying univariate distributions and multivariate dependencies.

Driven by the global decarbonization effort, the rapid integration of renewable energy into the conventional electricity grid presents new challenges and opportunities for the battery energy storage system (BESS) participating in the energy market. Energy arbitrage can be a significant source of revenue for the BESS due to the increasing price volatility in the spot market caused by the mismatch between renewable generation and electricity demand. In addition, the Frequency Control Ancillary Services (FCAS) markets established to stabilize the grid can offer higher returns for the BESS due to their capability to respond within milliseconds. Therefore, it is crucial for the BESS to carefully decide how much capacity to assign to each market to maximize the total profit under uncertain market conditions. This paper formulates the bidding problem of the BESS as a Markov Decision Process, which enables the BESS to participate in both the spot market and the FCAS market to maximize profit. Then, Proximal Policy Optimization, a model-free deep reinforcement learning algorithm, is employed to learn the optimal bidding strategy from the dynamic environment of the energy market under a continuous bidding scale. The proposed model is trained and validated using real-world historical data of the Australian National Electricity Market. The results demonstrate that our developed joint bidding strategy in both markets is significantly profitable compared to individual markets.

While many classical notions of learnability (e.g., PAC learnability) are distribution-free, utilizing the specific structures of an input distribution may improve learning performance. For example, a product distribution on a multi-dimensional input space has a much simpler structure than a correlated distribution. A recent paper [GHTZ21] shows that the sample complexity of a general learning problem on product distributions is polynomial in the input dimension, which is exponentially smaller than that on correlated distributions. However, the learning algorithm they use is not the standard Empirical Risk Minimization (ERM) algorithm. In this note, we characterize the sample complexity of ERM in a general learning problem on product distributions. We show that, even though product distributions are simpler than correlated distributions, ERM still needs an exponential number of samples to learn on product distributions, instead of a polynomial. This leads to the conclusion that a product distribution by itself does not make a learning problem easier -- an algorithm designed specifically for product distributions is needed.

There has been a concurrent significant improvement in the medical images used to facilitate diagnosis and the performance of machine learning techniques to perform tasks such as classification, detection, and segmentation in recent years. As a result, a rapid increase in the usage of such systems can be observed in the healthcare industry, for instance in the form of medical image classification systems, where these models have achieved diagnostic parity with human physicians. One such application where this can be observed is in computer vision tasks such as the classification of skin lesions in dermatoscopic images. However, as stakeholders in the healthcare industry, such as insurance companies, continue to invest extensively in machine learning infrastructure, it becomes increasingly important to understand the vulnerabilities in such systems. Due to the highly critical nature of the tasks being carried out by these machine learning models, it is necessary to analyze techniques that could be used to take advantage of these vulnerabilities and methods to defend against them. This paper explores common adversarial attack techniques. The Fast Sign Gradient Method and Projected Descent Gradient are used against a Convolutional Neural Network trained to classify dermatoscopic images of skin lesions. Following that, it also discusses one of the most popular adversarial defense techniques, adversarial training. The performance of the model that has been trained on adversarial examples is then tested against the previously mentioned attacks, and recommendations to improve neural networks robustness are thus provided based on the results of the experiment.

For solving a broad class of nonconvex programming problems on an unbounded constraint set, we provide a self-adaptive step-size strategy that does not include line-search techniques and establishes the convergence of a generic approach under mild assumptions. Specifically, the objective function may not satisfy the convexity condition. Unlike descent line-search algorithms, it does not need a known Lipschitz constant to figure out how big the first step should be. The crucial feature of this process is the steady reduction of the step size until a certain condition is fulfilled. In particular, it can provide a new gradient projection approach to optimization problems with an unbounded constrained set. The correctness of the proposed method is verified by preliminary results from some computational examples. To demonstrate the effectiveness of the proposed technique for large-scale problems, we apply it to some experiments on machine learning, such as supervised feature selection, multi-variable logistic regressions and neural networks for classification.

We present the Group Propagation Vision Transformer (GPViT): a novel nonhierarchical (i.e. non-pyramidal) transformer model designed for general visual recognition with high-resolution features. High-resolution features (or tokens) are a natural fit for tasks that involve perceiving fine-grained details such as detection and segmentation, but exchanging global information between these features is expensive in memory and computation because of the way self-attention scales. We provide a highly efficient alternative Group Propagation Block (GP Block) to exchange global information. In each GP Block, features are first grouped together by a fixed number of learnable group tokens; we then perform Group Propagation where global information is exchanged between the grouped features; finally, global information in the updated grouped features is returned back to the image features through a transformer decoder. We evaluate GPViT on a variety of visual recognition tasks including image classification, semantic segmentation, object detection, and instance segmentation. Our method achieves significant performance gains over previous works across all tasks, especially on tasks that require high-resolution outputs, for example, our GPViT-L3 outperforms Swin Transformer-B by 2.0 mIoU on ADE20K semantic segmentation with only half as many parameters. Code and pre-trained models are available at https://github.com/ChenhongyiYang/GPViT .

The rapid adoption of residential solar photovoltaics (PV) has resulted in regular overvoltage events, due to correlated reverse power flows. Currently, PV inverters prevent damage to electronics by curtailing energy production in response to overvoltage. However, this disproportionately affects households at the far end of the feeder, leading to an unfair allocation of the potential value of energy produced. Globally optimizing for fair curtailment requires accurate feeder parameters, which are often unknown. This paper investigates reinforcement learning, which gradually optimizes a fair PV curtailment strategy by interacting with the system. We evaluate six fairness metrics on how well they can be learned compared to an optimal solution oracle. We show that all definitions permit efficient learning, suggesting that reinforcement learning is a promising approach to achieving both safe and fair PV coordination.

This work addresses the problems of (a) designing utilization measurements of trained artificial intelligence (AI) models and (b) explaining how training data are encoded in AI models based on those measurements. The problems are motivated by the lack of explainability of AI models in security and safety critical applications, such as the use of AI models for classification of traffic signs in self-driving cars. We approach the problems by introducing theoretical underpinnings of AI model utilization measurement and understanding patterns in utilization-based class encodings of traffic signs at the level of computation graphs (AI models), subgraphs, and graph nodes. Conceptually, utilization is defined at each graph node (computation unit) of an AI model based on the number and distribution of unique outputs in the space of all possible outputs (tensor-states). In this work, utilization measurements are extracted from AI models, which include poisoned and clean AI models. In contrast to clean AI models, the poisoned AI models were trained with traffic sign images containing systematic, physically realizable, traffic sign modifications (i.e., triggers) to change a correct class label to another label in a presence of such a trigger. We analyze class encodings of such clean and poisoned AI models, and conclude with implications for trojan injection and detection.

In real-world time series recognition applications, it is possible to have data with varying length patterns. However, when using artificial neural networks (ANN), it is standard practice to use fixed-sized mini-batches. To do this, time series data with varying lengths are typically normalized so that all the patterns are the same length. Normally, this is done using zero padding or truncation without much consideration. We propose a novel method of normalizing the lengths of the time series in a dataset by exploiting the dynamic matching ability of Dynamic Time Warping (DTW). In this way, the time series lengths in a dataset can be set to a fixed size while maintaining features typical to the dataset. In the experiments, all 11 datasets with varying length time series from the 2018 UCR Time Series Archive are used. We evaluate the proposed method by comparing it with 18 other length normalization methods on a Convolutional Neural Network (CNN), a Long-Short Term Memory network (LSTM), and a Bidirectional LSTM (BLSTM).

Artificial intelligence is to teach machines to take actions like humans. To achieve intelligent teaching, the machine learning community becomes to think about a promising topic named machine teaching where the teacher is to design the optimal (usually minimal) teaching set given a target model and a specific learner. However, previous works usually require numerous teaching examples along with large iterations to guide learners to converge, which is costly. In this paper, we consider a more intelligent teaching paradigm named one-shot machine teaching which costs fewer examples to converge faster. Different from typical teaching, this advanced paradigm establishes a tractable mapping from the teaching set to the model parameter. Theoretically, we prove that this mapping is surjective, which serves to an existence guarantee of the optimal teaching set. Then, relying on the surjective mapping from the teaching set to the parameter, we develop a design strategy of the optimal teaching set under appropriate settings, of which two popular efficiency metrics, teaching dimension and iterative teaching dimension are one. Extensive experiments verify the efficiency of our strategy and further demonstrate the intelligence of this new teaching paradigm.  ( 2 min )

Various methods using machine and deep learning have been proposed to tackle different tasks in predictive process monitoring, forecasting for an ongoing case e.g. the most likely next event or suffix, its remaining time, or an outcome-related variable. Recurrent neural networks (RNNs), and more specifically long short-term memory nets (LSTMs), stand out in terms of popularity. In this work, we investigate the capabilities of such an LSTM to actually learn the underlying process model structure of an event log. We introduce an evaluation framework that combines variant-based resampling and custom metrics for fitness, precision and generalization. We evaluate 4 hypotheses concerning the learning capabilities of LSTMs, the effect of overfitting countermeasures, the level of incompleteness in the training set and the level of parallelism in the underlying process model. We confirm that LSTMs can struggle to learn process model structure, even with simplistic process data and in a very lenient setup. Taking the correct anti-overfitting measures can alleviate the problem. However, these measures did not present themselves to be optimal when selecting hyperparameters purely on predicting accuracy. We also found that decreasing the amount of information seen by the LSTM during training, causes a sharp drop in generalization and precision scores. In our experiments, we could not identify a relationship between the extent of parallelism in the model and the generalization capability, but they do indicate that the process' complexity might have impact.  ( 2 min )

Score-based generative models are shown to achieve remarkable empirical performances in various applications such as image generation and audio synthesis. However, a theoretical understanding of score-based diffusion models is still incomplete. Recently, Song et al. showed that the training objective of score-based generative models is equivalent to minimizing the Kullback-Leibler divergence of the generated distribution from the data distribution. In this work, we show that score-based models also minimize the Wasserstein distance between them under suitable assumptions on the model. Specifically, we prove that the Wasserstein distance is upper bounded by the square root of the objective function up to multiplicative constants and a fixed constant offset. Our proof is based on a novel application of the theory of optimal transport, which can be of independent interest to the society. Our numerical experiments support our findings. By analyzing our upper bounds, we provide a few techniques to obtain tighter upper bounds.  ( 2 min )

Cell-free massive MIMO is emerging as a promising technology for future wireless communication systems, which is expected to offer uniform coverage and high spectral efficiency compared to classical cellular systems. We study in this paper how cell-free massive MIMO can support federated edge learning. Taking advantage of the additive nature of the wireless multiple access channel, over-the-air computation is exploited, where the clients send their local updates simultaneously over the same communication resource. This approach, known as over-the-air federated learning (OTA-FL), is proven to alleviate the communication overhead of federated learning over wireless networks. Considering channel correlation and only imperfect channel state information available at the central server, we propose a practical implementation of OTA-FL over cell-free massive MIMO. The convergence of the proposed implementation is studied analytically and experimentally, confirming the benefits of cell-free massive MIMO for OTA-FL.  ( 2 min )

Accurate uncertainty quantification is necessary to enhance the reliability of deep learning models in real-world applications. In the case of regression tasks, prediction intervals (PIs) should be provided along with the deterministic predictions of deep learning models. Such PIs are useful or "high-quality'' as long as they are sufficiently narrow and capture most of the probability density. In this paper, we present a method to learn prediction intervals for regression-based neural networks automatically in addition to the conventional target predictions. In particular, we train two companion neural networks: one that uses one output, the target estimate, and another that uses two outputs, the upper and lower bounds of the corresponding PI. Our main contribution is the design of a loss function for the PI-generation network that takes into account the output of the target-estimation network and has two optimization objectives: minimizing the mean prediction interval width and ensuring the PI integrity using constraints that maximize the prediction interval probability coverage implicitly. Both objectives are balanced within the loss function using a self-adaptive coefficient. Furthermore, we apply a Monte Carlo-based approach that evaluates the model uncertainty in the learned PIs. Experiments using a synthetic dataset, six benchmark datasets, and a real-world crop yield prediction dataset showed that our method was able to maintain a nominal probability coverage and produce narrower PIs without detriment to its target estimation accuracy when compared to those PIs generated by three state-of-the-art neural-network-based methods.  ( 2 min )

Recent works have investigated the role of graph bottlenecks in preventing long-range information propagation in message-passing graph neural networks, causing the so-called `over-squashing' phenomenon. As a remedy, graph rewiring mechanisms have been proposed as preprocessing steps. Graph Echo State Networks (GESNs) are a reservoir computing model for graphs, where node embeddings are recursively computed by an untrained message-passing function. In this paper, we show that GESNs can achieve a significantly better accuracy on six heterophilic node classification tasks without altering the graph connectivity, thus suggesting a different route for addressing the over-squashing problem.  ( 2 min )

Global pooling is one of the most significant operations in many machine learning models and tasks, which works for information fusion and structured data (like sets and graphs) representation. However, without solid mathematical fundamentals, its practical implementations often depend on empirical mechanisms and thus lead to sub-optimal, even unsatisfactory performance. In this work, we develop a novel and generalized global pooling framework through the lens of optimal transport. The proposed framework is interpretable from the perspective of expectation-maximization. Essentially, it aims at learning an optimal transport across sample indices and feature dimensions, making the corresponding pooling operation maximize the conditional expectation of input data. We demonstrate that most existing pooling methods are equivalent to solving a regularized optimal transport (ROT) problem with different specializations, and more sophisticated pooling operations can be implemented by hierarchically solving multiple ROT problems. Making the parameters of the ROT problem learnable, we develop a family of regularized optimal transport pooling (ROTP) layers. We implement the ROTP layers as a new kind of deep implicit layer. Their model architectures correspond to different optimization algorithms. We test our ROTP layers in several representative set-level machine learning scenarios, including multi-instance learning (MIL), graph classification, graph set representation, and image classification. Experimental results show that applying our ROTP layers can reduce the difficulty of the design and selection of global pooling -- our ROTP layers may either imitate some existing global pooling methods or lead to some new pooling layers fitting data better. The code is available at \url{https://github.com/SDS-Lab/ROT-Pooling}.  ( 2 min )

Brain-computer interface (BCI) is a communication system between humans and computers reflecting human intention without using a physical control device. Since deep learning is robust in extracting features from data, research on decoding electroencephalograms by applying deep learning has progressed in the BCI domain. However, the application of deep learning in the BCI domain has issues with a lack of data and overconfidence. To solve these issues, we proposed a novel data augmentation method, CropCat. CropCat consists of two versions, CropCat-spatial and CropCat-temporal. We designed our method by concatenating the cropped data after cropping the data, which have different labels in spatial and temporal axes. In addition, we adjusted the label based on the ratio of cropped length. As a result, the generated data from our proposed method assisted in revising the ambiguous decision boundary into apparent caused by a lack of data. Due to the effectiveness of the proposed method, the performance of the four EEG signal decoding models is improved in two motor imagery public datasets compared to when the proposed method is not applied. Hence, we demonstrate that generated data by CropCat smooths the feature distribution of EEG signals when training the model.  ( 2 min )

Automatic fake news detection is a challenging problem in misinformation spreading, and it has tremendous real-world political and social impacts. Past studies have proposed machine learning-based methods for detecting such fake news, focusing on different properties of the published news articles, such as linguistic characteristics of the actual content, which however have limitations due to the apparent language barriers. Departing from such efforts, we propose FNDaaS, the first automatic, content-agnostic fake news detection method, that considers new and unstudied features such as network and structural characteristics per news website. This method can be enforced as-a-Service, either at the ISP-side for easier scalability and maintenance, or user-side for better end-user privacy. We demonstrate the efficacy of our method using data crawled from existing lists of 637 fake and 1183 real news websites, and by building and testing a proof of concept system that materializes our proposal. Our analysis of data collected from these websites shows that the vast majority of fake news domains are very young and appear to have lower time periods of an IP associated with their domain than real news ones. By conducting various experiments with machine learning classifiers, we demonstrate that FNDaaS can achieve an AUC score of up to 0.967 on past sites, and up to 77-92% accuracy on newly-flagged ones.  ( 2 min )

Reinforcement learning (RL) is one of the most vibrant research frontiers in machine learning and has been recently applied to solve a number of challenging problems. In this paper, we primarily focus on off-policy evaluation (OPE), one of the most fundamental topics in RL. In recent years, a number of OPE methods have been developed in the statistics and computer science literature. We provide a discussion on the efficiency bound of OPE, some of the existing state-of-the-art OPE methods, their statistical properties and some other related research directions that are currently actively explored.  ( 2 min )

The simple idea that not all things are equally difficult has surprising implications when applied in a fairness context. In this work we explore how "difficulty" is model-specific, such that different models find different parts of a dataset challenging. When difficulty correlates with group information, we term this difficulty disparity. Drawing a connection with recent work exploring the inductive bias towards simplicity of SGD-trained models, we show that when such a disparity exists, it is further amplified by commonly-used models. We quantify this amplification factor across a range of settings aiming towards a fuller understanding of the role of model bias. We also present a challenge to the simplifying assumption that "fixing" a dataset is sufficient to ensure unbiased performance.  ( 2 min )

This paper studies a class of multi-agent reinforcement learning (MARL) problems where the reward that an agent receives depends on the states of other agents, but the next state only depends on the agent's own current state and action. We name it REC-MARL standing for REward-Coupled Multi-Agent Reinforcement Learning. REC-MARL has a range of important applications such as real-time access control and distributed power control in wireless networks. This paper presents a distributed and optimal policy gradient algorithm for REC-MARL. The proposed algorithm is distributed in two aspects: (i) the learned policy is a distributed policy that maps a local state of an agent to its local action and (ii) the learning/training is distributed, during which each agent updates its policy based on its own and neighbors' information. The learned policy is provably optimal among all local policies and its regret bounds depend on the dimension of local states and actions. This distinguishes our result from most existing results on MARL, which often obtain stationary-point policies. The experimental results of our algorithm for the real-time access control and power control in wireless networks show that our policy significantly outperforms the state-of-the-art algorithms and well-known benchmarks.

Traffic forecasting has attracted widespread attention recently. In reality, traffic data usually contains missing values due to sensor or communication errors. The Spatio-temporal feature in traffic data brings more challenges for processing such missing values, for which the classic techniques (e.g., data imputations) are limited: 1) in temporal axis, the values can be randomly or consecutively missing; 2) in spatial axis, the missing values can happen on one single sensor or on multiple sensors simultaneously. Recent models powered by Graph Neural Networks achieved satisfying performance on traffic forecasting tasks. However, few of them are applicable to such a complex missing-value context. To this end, we propose GCN-M, a Graph Convolutional Network model with the ability to handle the complex missing values in the Spatio-temporal context. Particularly, we jointly model the missing value processing and traffic forecasting tasks, considering both local Spatio-temporal features and global historical patterns in an attention-based memory network. We propose as well a dynamic graph learning module based on the learned local-global features. The experimental results on real-life datasets show the reliability of our proposed method.  ( 2 min )

An eco-system of agents each having their own policy with some, but limited, generalizability has proven to be a reliable approach to increase generalization across procedurally generated environments. In such an approach, new agents are regularly added to the eco-system when encountering a new environment that is outside of the scope of the eco-system. The speed of adaptation and general effectiveness of the eco-system approach highly depends on the initialization of new agents. In this paper we propose different techniques for such initialization and study their impact. We then rework the ecosystem setup to use forked agents which brings better results than the initial eco-system approach with a drastically reduced number of training cycles.  ( 2 min )

Convolutional neural networks (CNNs) are currently among the most widely-used neural networks available and achieve state-of-the-art performance for many problems. While originally applied to computer vision tasks, CNNs work well with any data with a spatial relationship, besides images, and have been applied to different fields. However, recent works have highlighted how CNNs, like other deep learning models, are sensitive to noise injection which can jeopardise their performance. This paper quantifies the numerical uncertainty of the floating point arithmetic inaccuracies of the inference stage of DeepGOPlus, a CNN that predicts protein function, in order to determine its numerical stability. In addition, this paper investigates the possibility to use reduced-precision floating point formats for DeepGOPlus inference to reduce memory consumption and latency. This is achieved with Monte Carlo Arithmetic, a technique that experimentally quantifies floating point operation errors and VPREC, a tool that emulates results with customizable floating point precision formats. Focus is placed on the inference stage as it is the main deliverable of the DeepGOPlus model that will be used across environments and therefore most likely be subjected to the most amount of noise. Furthermore, studies have shown that the inference stage is the part of the model which is most disposed to being scaled down in terms of reduced precision. All in all, it has been found that the numerical uncertainty of the DeepGOPlus CNN is very low at its current numerical precision format, but the model cannot currently be reduced to a lower precision that might render it more lightweight.  ( 2 min )

Photonic neural network (PNN) is a remarkable analog artificial intelligence (AI) accelerator that computes with photons instead of electrons to feature low latency, high energy efficiency, and high parallelism. However, the existing training approaches cannot address the extensive accumulation of systematic errors in large-scale PNNs, resulting in a significant decrease in model performance in physical systems. Here, we propose dual adaptive training (DAT) that allows the PNN model to adapt to substantial systematic errors and preserves its performance during the deployment. By introducing the systematic error prediction networks with task-similarity joint optimization, DAT achieves the high similarity mapping between the PNN numerical models and physical systems and high-accurate gradient calculations during the dual backpropagation training. We validated the effectiveness of DAT by using diffractive PNNs and interference-based PNNs on image classification tasks. DAT successfully trained large-scale PNNs under major systematic errors and preserved the model classification accuracies comparable to error-free systems. The results further demonstrated its superior performance over the state-of-the-art in situ training approaches. DAT provides critical support for constructing large-scale PNNs to achieve advanced architectures and can be generalized to other types of AI systems with analog computing errors.  ( 2 min )

Proximal Policy Optimization (PPO) is a highly popular policy-based deep reinforcement learning (DRL) approach. However, we observe that the homogeneous exploration process in PPO could cause an unexpected stability issue in the training phase. To address this issue, we propose PPO-UE, a PPO variant equipped with self-adaptive uncertainty-aware explorations (UEs) based on a ratio uncertainty level. The proposed PPO-UE is designed to improve convergence speed and performance with an optimized ratio uncertainty level. Through extensive sensitivity analysis by varying the ratio uncertainty level, our proposed PPO-UE considerably outperforms the baseline PPO in Roboschool continuous control tasks.  ( 2 min )

Deep neural operators can learn nonlinear mappings between infinite-dimensional function spaces via deep neural networks. As promising surrogate solvers of partial differential equations (PDEs) for real-time prediction, deep neural operators such as deep operator networks (DeepONets) provide a new simulation paradigm in science and engineering. Pure data-driven neural operators and deep learning models, in general, are usually limited to interpolation scenarios, where new predictions utilize inputs within the support of the training set. However, in the inference stage of real-world applications, the input may lie outside the support, i.e., extrapolation is required, which may result to large errors and unavoidable failure of deep learning models. Here, we address this challenge of extrapolation for deep neural operators. First, we systematically investigate the extrapolation behavior of DeepONets by quantifying the extrapolation complexity via the 2-Wasserstein distance between two function spaces and propose a new behavior of bias-variance trade-off for extrapolation with respect to model capacity. Subsequently, we develop a complete workflow, including extrapolation determination, and we propose five reliable learning methods that guarantee a safe prediction under extrapolation by requiring additional information -- the governing PDEs of the system or sparse new observations. The proposed methods are based on either fine-tuning a pre-trained DeepONet or multifidelity learning. We demonstrate the effectiveness of the proposed framework for various types of parametric PDEs. Our systematic comparisons provide practical guidelines for selecting a proper extrapolation method depending on the available information, desired accuracy, and required inference speed.  ( 2 min )

The performance of differentially private machine learning can be boosted significantly by leveraging the transfer learning capabilities of non-private models pretrained on large public datasets. We critically review this approach. We primarily question whether the use of large Web-scraped datasets should be viewed as differential-privacy-preserving. We caution that publicizing these models pretrained on Web data as "private" could lead to harm and erode the public's trust in differential privacy as a meaningful definition of privacy. Beyond the privacy considerations of using public data, we further question the utility of this paradigm. We scrutinize whether existing machine learning benchmarks are appropriate for measuring the ability of pretrained models to generalize to sensitive domains, which may be poorly represented in public Web data. Finally, we notice that pretraining has been especially impactful for the largest available models -- models sufficiently large to prohibit end users running them on their own devices. Thus, deploying such models today could be a net loss for privacy, as it would require (private) data to be outsourced to a more compute-powerful third party. We conclude by discussing potential paths forward for the field of private learning, as public pretraining becomes more popular and powerful.  ( 2 min )

The estimation of the generalization error of classifiers often relies on a validation set. Such a set is hardly available in few-shot learning scenarios, a highly disregarded shortcoming in the field. In these scenarios, it is common to rely on features extracted from pre-trained neural networks combined with distance-based classifiers such as nearest class mean. In this work, we introduce a Gaussian model of the feature distribution. By estimating the parameters of this model, we are able to predict the generalization error on new classification tasks with few samples. We observe that accurate distance estimates between class-conditional densities are the key to accurate estimates of the generalization performance. Therefore, we propose an unbiased estimator for these distances and integrate it in our numerical analysis. We show that our approach outperforms alternatives such as the leave-one-out cross-validation strategy in few-shot settings.  ( 2 min )

The exercise of detecting similar bug reports in bug tracking systems is known as duplicate bug report detection. Having prior knowledge of a bug report's existence reduces efforts put into debugging problems and identifying the root cause. Rule and Query-based solutions recommend a long list of potential similar bug reports with no clear ranking. In addition, triage engineers are less motivated to spend time going through an extensive list. Consequently, this deters the use of duplicate bug report retrieval solutions. In this paper, we have proposed a solution using a combination of NLP techniques. Our approach considers unstructured and structured attributes of a bug report like summary, description and severity, impacted products, platforms, categories, etc. It uses a custom data transformer, a deep neural network, and a non-generalizing machine learning method to retrieve existing identical bug reports. We have performed numerous experiments with significant data sources containing thousands of bug reports and showcased that the proposed solution achieves a high retrieval accuracy of 70% for recall@5.  ( 2 min )

Science tests competing theories or models by evaluating the similarity of their predictions against observational experience. Thus, how we measure similarity fundamentally determines what we learn. In machine learning and scientific modeling, similarity metrics are used as objective functions. A classic example being mean squared error, which is the optimal measure of similarity when errors are normally distributed and independent and identically distributed (iid). In many cases, however, the error distribution is neither normal nor iid, so it is left to the scientist to determine an appropriate objective. Here, we review how information theory can guide that selection, then demonstrate the approach with a simple hydrologic model.

Independent component analysis (ICA) is a blind source separation method to recover source signals of interest from their mixtures. Most existing ICA procedures assume independent sampling. Second-order-statistics-based source separation methods have been developed based on parametric time series models for the mixtures from the autocorrelated sources. However, the second-order-statistics-based methods cannot separate the sources accurately when the sources have temporal autocorrelations with mixed spectra. To address this issue, we propose a new ICA method by estimating spectral density functions and line spectra of the source signals using cubic splines and indicator functions, respectively. The mixed spectra and the mixing matrix are estimated by maximizing the Whittle likelihood function. We illustrate the performance of the proposed method through simulation experiments and an EEG data application. The numerical results indicate that our approach outperforms existing ICA methods, including SOBI algorithms. In addition, we investigate the asymptotic behavior of the proposed method.  ( 2 min )

The performance of decision policies and prediction models often deteriorates when applied to environments different from the ones seen during training. To ensure reliable operation, we propose and analyze the stability of a system under distribution shift, which is defined as the smallest change in the underlying environment that causes the system's performance to deteriorate beyond a permissible threshold. In contrast to standard tail risk measures and distributionally robust losses that require the specification of a plausible magnitude of distribution shift, the stability measure is defined in terms of a more intuitive quantity: the level of acceptable performance degradation. We develop a minimax optimal estimator of stability and analyze its convergence rate, which exhibits a fundamental phase shift behavior. Our characterization of the minimax convergence rate shows that evaluating stability against large performance degradation incurs a statistical cost. Empirically, we demonstrate the practical utility of our stability framework by using it to compare system designs on problems where robustness to distribution shift is critical.  ( 2 min )

The cyber-physical convergence is opening up new business opportunities for industrial operators. The need for deep integration of the cyber and the physical worlds establishes a rich business agenda towards consolidating new system and network engineering approaches. This revolution would not be possible without the rich and heterogeneous sources of data, as well as the ability of their intelligent exploitation, mainly due to the fact that data will serve as a fundamental resource to promote Industry 4.0. One of the most fruitful research and practice areas emerging from this data-rich, cyber-physical, smart factory environment is the data-driven process monitoring field, which applies machine learning methodologies to enable predictive maintenance applications. In this paper, we examine popular time series forecasting techniques as well as supervised machine learning algorithms in the applied context of Industry 4.0, by transforming and preprocessing the historical industrial dataset of a packing machine's operational state recordings (real data coming from the production line of a manufacturing plant from the food and beverage domain). In our methodology, we use only a single signal concerning the machine's operational status to make our predictions, without considering other operational variables or fault and warning signals, hence its characterization as ``agnostic''. In this respect, the results demonstrate that the adopted methods achieve a quite promising performance on three targeted use cases.  ( 2 min )

Methods for learning optimal policies use causal machine learning models to create human-interpretable rules for making choices around the allocation of different policy interventions. However, in realistic policy-making contexts, decision-makers often care about trade-offs between outcomes, not just singlemindedly maximising utility for one outcome. This paper proposes an approach termed Multi-Objective Policy Learning (MOPoL) which combines optimal decision trees for policy learning with a multi-objective Bayesian optimisation approach to explore the trade-off between multiple outcomes. It does this by building a Pareto frontier of non-dominated models for different hyperparameter settings. The key here is that a low-cost surrogate function can be an accurate proxy for the very computationally costly optimal tree in terms of expected regret. This surrogate can be fit many times with different hyperparameter values to proxy the performance of the optimal model. The method is applied to a real-world case-study of conditional cash transfers in Morocco where hybrid (partially optimal, partially greedy) policy trees provide good performance as a surrogate for optimal trees while being computationally cheap enough to feasibly fit a Pareto frontier.  ( 2 min )

Deep learning classifiers provide the most accurate means of automatically diagnosing diabetic retinopathy (DR) based on optical coherence tomography (OCT) and its angiography (OCTA). The power of these models is attributable in part to the inclusion of hidden layers that provide the complexity required to achieve a desired task. However, hidden layers also render algorithm outputs difficult to interpret. Here we introduce a novel biomarker activation map (BAM) framework based on generative adversarial learning that allows clinicians to verify and understand classifiers decision-making. A data set including 456 macular scans were graded as non-referable or referable DR based on current clinical standards. A DR classifier that was used to evaluate our BAM was first trained based on this data set. The BAM generation framework was designed by combing two U-shaped generators to provide meaningful interpretability to this classifier. The main generator was trained to take referable scans as input and produce an output that would be classified by the classifier as non-referable. The BAM is then constructed as the difference image between the output and input of the main generator. To ensure that the BAM only highlights classifier-utilized biomarkers an assistant generator was trained to do the opposite, producing scans that would be classified as referable by the classifier from non-referable scans. The generated BAMs highlighted known pathologic features including nonperfusion area and retinal fluid. A fully interpretable classifier based on these highlights could help clinicians better utilize and verify automated DR diagnosis.  ( 2 min )

Non-invasive prostate cancer detection from MRI has the potential to revolutionize patient care by providing early detection of clinically-significant disease (ISUP grade group >= 2), but has thus far shown limited positive predictive value. To address this, we present an MRI-based deep learning method for predicting clinically significant prostate cancer applicable to a patient population with subsequent ground truth biopsy results ranging from benign pathology to ISUP grade group~5. Specifically, we demonstrate that mixed supervision via diverse histopathological ground truth improves classification performance despite the cost of reduced concordance with image-based segmentation. That is, where prior approaches have utilized pathology results as ground truth derived from targeted biopsies and whole-mount prostatectomy to strongly supervise the localization of clinically significant cancer, our approach also utilizes weak supervision signals extracted from nontargeted systematic biopsies with regional localization to improve overall performance. Our key innovation is performing regression by distribution rather than simply by value, enabling use of additional pathology findings traditionally ignored by deep learning strategies. We evaluated our model on a dataset of 973 (testing n=160) multi-parametric prostate MRI exams collected at UCSF from 2015-2018 followed by MRI/ultrasound fusion (targeted) biopsy and systematic (nontargeted) biopsy of the prostate gland, demonstrating that deep networks trained with mixed supervision of histopathology can significantly exceed the performance of the Prostate Imaging-Reporting and Data System (PI-RADS) clinical standard for prostate MRI interpretation.  ( 2 min )

Federated learning (FL) is an emerging machine learning paradigm, in which clients jointly learn a model with the help of a cloud server. A fundamental challenge of FL is that the clients are often heterogeneous, e.g., they have different computing powers, and thus the clients may send model updates to the server with substantially different delays. Asynchronous FL aims to address this challenge by enabling the server to update the model once any client's model update reaches it without waiting for other clients' model updates. However, like synchronous FL, asynchronous FL is also vulnerable to poisoning attacks, in which malicious clients manipulate the model via poisoning their local data and/or model updates sent to the server. Byzantine-robust FL aims to defend against poisoning attacks. In particular, Byzantine-robust FL can learn an accurate model even if some clients are malicious and have Byzantine behaviors. However, most existing studies on Byzantine-robust FL focused on synchronous FL, leaving asynchronous FL largely unexplored. In this work, we bridge this gap by proposing AFLGuard, a Byzantine-robust asynchronous FL method. We show that, both theoretically and empirically, AFLGuard is robust against various existing and adaptive poisoning attacks (both untargeted and targeted). Moreover, AFLGuard outperforms existing Byzantine-robust asynchronous FL methods.  ( 2 min )

We study the sample complexity of reducing reinforcement learning to a sequence of empirical risk minimization problems over the policy space. Such reductions-based algorithms exhibit local convergence in the function space, as opposed to the parameter space for policy gradient algorithms, and thus are unaffected by the possibly non-linear or discontinuous parameterization of the policy class. We propose a variance-reduced variant of Conservative Policy Iteration that improves the sample complexity of producing a $\varepsilon$-functional local optimum from $O(\varepsilon^{-4})$ to $O(\varepsilon^{-3})$. Under state-coverage and policy-completeness assumptions, the algorithm enjoys $\varepsilon$-global optimality after sampling $O(\varepsilon^{-2})$ times, improving upon the previously established $O(\varepsilon^{-3})$ sample requirement.  ( 2 min )

In this paper, we revisit the class of iterative shrinkage-thresholding algorithms (ISTA) for solving the linear inverse problem with sparse representation, which arises in signal and image processing. It is shown in the numerical experiment to deblur an image that the convergence behavior in the logarithmic-scale ordinate tends to be linear instead of logarithmic, approximating to be flat. Making meticulous observations, we find that the previous assumption for the smooth part to be convex weakens the least-square model. Specifically, assuming the smooth part to be strongly convex is more reasonable for the least-square model, even though the image matrix is probably ill-conditioned. Furthermore, we improve the pivotal inequality tighter for composite optimization with the smooth part to be strongly convex instead of general convex, which is first found in [Li et al., 2022]. Based on this pivotal inequality, we generalize the linear convergence to composite optimization in both the objective value and the squared proximal subgradient norm. Meanwhile, we set a simple ill-conditioned matrix which is easy to compute the singular values instead of the original blur matrix. The new numerical experiment shows the proximal generalization of Nesterov's accelerated gradient descent (NAG) for the strongly convex function has a faster linear convergence rate than ISTA. Based on the tighter pivotal inequality, we also generalize the faster linear convergence rate to composite optimization, in both the objective value and the squared proximal subgradient norm, by taking advantage of the well-constructed Lyapunov function with a slight modification and the phase-space representation based on the high-resolution differential equation framework from the implicit-velocity scheme.  ( 2 min )

We propose a framework in which multiple entities collaborate to build a machine learning model while preserving privacy of their data. The approach utilizes feature embeddings from shared/per-entity feature extractors transforming data into a feature space for cooperation between entities. We propose two specific methods and compare them with a baseline method. In Shared Feature Extractor (SFE) Learning, the entities use a shared feature extractor to compute feature embeddings of samples. In Locally Trained Feature Extractor (LTFE) Learning, each entity uses a separate feature extractor and models are trained using concatenated features from all entities. As a baseline, in Cooperatively Trained Feature Extractor (CTFE) Learning, the entities train models by sharing raw data. Secure multi-party algorithms are utilized to train models without revealing data or features in plain text. We investigate the trade-offs among SFE, LTFE, and CTFE in regard to performance, privacy leakage (using an off-the-shelf membership inference attack), and computational cost. LTFE provides the most privacy, followed by SFE, and then CTFE. Computational cost is lowest for SFE and the relative speed of CTFE and LTFE depends on network architecture. CTFE and LTFE provide the best accuracy. We use MNIST, a synthetic dataset, and a credit card fraud detection dataset for evaluations.  ( 2 min )

Online personalized recommendation services are generally hosted in the cloud where users query the cloud-based model to receive recommended input such as merchandise of interest or news feed. State-of-the-art recommendation models rely on sparse and dense features to represent users' profile information and the items they interact with. Although sparse features account for 99% of the total model size, there was not enough attention paid to the potential information leakage through sparse features. These sparse features are employed to track users' behavior, e.g., their click history, object interactions, etc., potentially carrying each user's private information. Sparse features are represented as learned embedding vectors that are stored in large tables, and personalized recommendation is performed by using a specific user's sparse feature to index through the tables. Even with recently-proposed methods that hides the computation happening in the cloud, an attacker in the cloud may be able to still track the access patterns to the embedding tables. This paper explores the private information that may be learned by tracking a recommendation model's sparse feature access patterns. We first characterize the types of attacks that can be carried out on sparse features in recommendation models in an untrusted cloud, followed by a demonstration of how each of these attacks leads to extracting users' private information or tracking users by their behavior over time.  ( 2 min )

We consider the problem of improving the human instance segmentation mask quality for a given test image using keypoints estimation. We compare two alternative approaches. The first approach is a test-time adaptation (TTA) method, where we allow test-time modification of the segmentation network's weights using a single unlabeled test image. In this approach, we do not assume test-time access to the labeled source dataset. More specifically, our TTA method consists of using the keypoints estimates as pseudo labels and backpropagating them to adjust the backbone weights. The second approach is a training-time generalization (TTG) method, where we permit offline access to the labeled source dataset but not the test-time modification of weights. Furthermore, we do not assume the availability of any images from or knowledge about the target domain. Our TTG method consists of augmenting the backbone features with those generated by the keypoints head and feeding the aggregate vector to the mask head. Through a comprehensive set of ablations, we evaluate both approaches and identify several factors limiting the TTA gains. In particular, we show that in the absence of a significant domain shift, TTA may hurt and TTG show only a small gain in performance, whereas for a large domain shift, TTA gains are smaller and dependent on the heuristics used, while TTG gains are larger and robust to architectural choices.  ( 2 min )

Recent developments in in-situ monitoring and process control in Additive Manufacturing (AM), also known as 3D-printing, allows the collection of large amounts of emission data during the build process of the parts being manufactured. This data can be used as input into 3D and 2D representations of the 3D-printed parts. However the analysis and use, as well as the characterization of this data still remains a manual process. The aim of this paper is to propose an adaptive human-in-the-loop approach using Machine Learning techniques that automatically inspect and annotate the emissions data generated during the AM process. More specifically, this paper will look at two scenarios: firstly, using convolutional neural networks (CNNs) to automatically inspect and classify emission data collected by in-situ monitoring and secondly, applying Active Learning techniques to the developed classification model to construct a human-in-the-loop mechanism in order to accelerate the labeling process of the emission data. The CNN-based approach relies on transfer learning and fine-tuning, which makes the approach applicable to other industrial image patterns. The adaptive nature of the approach is enabled by uncertainty sampling strategy to automatic selection of samples to be presented to human experts for annotation.  ( 2 min )

Recent advances in safety-critical risk-aware control are predicated on apriori knowledge of the disturbances a system might face. This paper proposes a method to efficiently learn these disturbances online, in a risk-aware context. First, we introduce the concept of a Surface-at-Risk, a risk measure for stochastic processes that extends Value-at-Risk -- a commonly utilized risk measure in the risk-aware controls community. Second, we model the norm of the state discrepancy between the model and the true system evolution as a scalar-valued stochastic process and determine an upper bound to its Surface-at-Risk via Gaussian Process Regression. Third, we provide theoretical results on the accuracy of our fitted surface subject to mild assumptions that are verifiable with respect to the data sets collected during system operation. Finally, we experimentally verify our procedure by augmenting a drone's controller and highlight performance increases achieved via our risk-aware approach after collecting less than a minute of operating data.  ( 2 min )

Autoregressive processes naturally arise in a large variety of real-world scenarios, including e.g., stock markets, sell forecasting, weather prediction, advertising, and pricing. When addressing a sequential decision-making problem in such a context, the temporal dependence between consecutive observations should be properly accounted for converge to the optimal decision policy. In this work, we propose a novel online learning setting, named Autoregressive Bandits (ARBs), in which the observed reward follows an autoregressive process of order $k$, whose parameters depend on the action the agent chooses, within a finite set of $n$ actions. Then, we devise an optimistic regret minimization algorithm AutoRegressive Upper Confidence Bounds (AR-UCB) that suffers regret of order $\widetilde{\mathcal{O}} \left( \frac{(k+1)^{3/2}\sqrt{nT}}{(1-\Gamma)^2} \right)$, being $T$ the optimization horizon and $\Gamma < 1$ an index of the stability of the system. Finally, we present a numerical validation in several synthetic and one real-world setting, in comparison with general and specific purpose bandit baselines showing the advantages of the proposed approach.  ( 2 min )

Machine learning (ML) has recently facilitated many advances in solving problems related to many-body physical systems. Given the intrinsic quantum nature of these problems, it is natural to speculate that quantum-enhanced machine learning will enable us to unveil even greater details than we currently have. With this motivation, this paper examines a quantum machine learning approach based on shallow variational ansatz inspired by tensor networks for supervised learning tasks. In particular, we first look at the standard image classification tasks using the Fashion-MNIST dataset and study the effect of repeating tensor network layers on ansatz's expressibility and performance. Finally, we use this strategy to tackle the problem of quantum phase recognition for the transverse-field Ising and Heisenberg spin models in one and two dimensions, where we were able to reach $\geq 98\%$ test-set accuracies with both multi-scale entanglement renormalization ansatz (MERA) and tree tensor network (TTN) inspired parametrized quantum circuits.  ( 2 min )

Intensive Care in-hospital mortality prediction has various clinical applications. Neural prediction models, especially when capitalising on clinical notes, have been put forward as improvement on currently existing models. However, to be acceptable these models should be performant and transparent. This work studies different attention mechanisms for clinical neural prediction models in terms of their discrimination and calibration. Specifically, we investigate sparse attention as an alternative to dense attention weights in the task of in-hospital mortality prediction from clinical notes. We evaluate the attention mechanisms based on: i) local self-attention over words in a sentence, and ii) global self-attention with a transformer architecture across sentences. We demonstrate that the sparse mechanism approach outperforms the dense one for the local self-attention in terms of predictive performance with a publicly available dataset, and puts higher attention to prespecified relevant directive words. The performance at the sentence level, however, deteriorates as sentences including the influential directive words tend to be dropped all together.  ( 2 min )

Realistic synthetic image data rendered from 3D models can be used to augment image sets and train image classification semantic segmentation models. In this work, we explore how high quality physically-based rendering and domain randomization can efficiently create a large synthetic dataset based on production 3D CAD models of a real vehicle. We use this dataset to quantify the effectiveness of synthetic augmentation using U-net and Double-U-net models. We found that, for this domain, synthetic images were an effective technique for augmenting limited sets of real training data. We observed that models trained on purely synthetic images had a very low mean prediction IoU on real validation images. We also observed that adding even very small amounts of real images to a synthetic dataset greatly improved accuracy, and that models trained on datasets augmented with synthetic images were more accurate than those trained on real images alone. Finally, we found that in use cases that benefit from incremental training or model specialization, pretraining a base model on synthetic images provided a sizeable reduction in the training cost of transfer learning, allowing up to 90\% of the model training to be front-loaded.  ( 2 min )

Spurious correlations in training data often lead to robustness issues since models learn to use them as shortcuts. For example, when predicting whether an object is a cow, a model might learn to rely on its green background, so it would do poorly on a cow on a sandy background. A standard dataset for measuring state-of-the-art on methods mitigating this problem is Waterbirds. The best method (Group Distributionally Robust Optimization - GroupDRO) currently achieves 89\% worst group accuracy and standard training from scratch on raw images only gets 72\%. GroupDRO requires training a model in an end-to-end manner with subgroup labels. In this paper, we show that we can achieve up to 90\% accuracy without using any sub-group information in the training set by simply using embeddings from a large pre-trained vision model extractor and training a linear classifier on top of it. With experiments on a wide range of pre-trained models and pre-training datasets, we show that the capacity of the pre-training model and the size of the pre-training dataset matters. Our experiments reveal that high capacity vision transformers perform better compared to high capacity convolutional neural networks, and larger pre-training dataset leads to better worst-group accuracy on the spurious correlation dataset.  ( 2 min )

The tropical cyclone formation process is one of the most complex natural phenomena which is governed by various atmospheric, oceanographic, and geographic factors that varies with time and space. Despite several years of research, accurately predicting tropical cyclone formation remains a challenging task. While the existing numerical models have inherent limitations, the machine learning models fail to capture the spatial and temporal dimensions of the causal factors behind TC formation. In this study, a deep learning model has been proposed that can forecast the formation of a tropical cyclone with a lead time of up to 60 hours with high accuracy. The model uses the high-resolution reanalysis data ERA5 (ECMWF reanalysis 5th generation), and best track data IBTrACS (International Best Track Archive for Climate Stewardship) to forecast tropical cyclone formation in six ocean basins of the world. For 60 hours lead time the models achieve an accuracy in the range of 86.9% - 92.9% across the six ocean basins. The model takes about 5-15 minutes of training time depending on the ocean basin, and the amount of data used and can predict within seconds, thereby making it suitable for real-life usage.  ( 2 min )

Even though deep neural networks (DNNs) achieve state-of-the-art results for a number of problems involving genomic data, getting DNNs to explain their decision-making process has been a major challenge due to their black-box nature. One way to get DNNs to explain their reasoning for prediction is via attribution methods which are assumed to highlight the parts of the input that contribute to the prediction the most. Given the existence of numerous attribution methods and a lack of quantitative results on the fidelity of those methods, selection of an attribution method for sequence-based tasks has been mostly done qualitatively. In this work, we take a step towards identifying the most faithful attribution method by proposing a computational approach that utilizes point mutations. Providing quantitative results on seven popular attribution methods, we find Layerwise Relevance Propagation (LRP) to be the most appropriate one for translation initiation, with LRP identifying two important biological features for translation: the integrity of Kozak sequence as well as the detrimental effects of premature stop codons.  ( 2 min )

Fairness of machine learning (ML) software has become a major concern in the recent past. Although recent research on testing and improving fairness have demonstrated impact on real-world software, providing fairness guarantee in practice is still lacking. Certification of ML models is challenging because of the complex decision-making process of the models. In this paper, we proposed Fairify, the first SMT-based approach to verify individual fairness property in neural network (NN) models. Individual fairness ensures that any two similar individuals get similar treatment irrespective of their protected attributes e.g., race, sex, age. Verifying this fairness property is hard because of its global nature and the presence of non-linear computation nodes in NN. We proposed sound approach to make individual fairness verification tractable for the developers. The key idea is that many neurons in the NN always remain inactive when a smaller part of the input domain is considered. So, Fairify leverages white-box access to the models in production and then apply formal analysis based pruning. Our approach adopts input partitioning and then prunes the NN for each partition to provide fairness certification or counterexample. We leveraged interval arithmetic and activation heuristic of the neurons to perform the pruning as necessary. We evaluated Fairify on 25 real-world neural networks collected from four different sources, and demonstrated the effectiveness, scalability and performance over baseline and closely related work. Fairify is also configurable based on the domain and size of the NN. Our novel formulation of the problem can answer targeted verification queries with relaxations and counterexamples, which have practical implications.  ( 2 min )

Long-range time series forecasting is usually based on one of two existing forecasting strategies: Direct Forecasting and Iterative Forecasting, where the former provides low bias, high variance forecasts and the latter leads to low variance, high bias forecasts. In this paper, we propose a new forecasting strategy called Generative Forecasting (GenF), which generates synthetic data for the next few time steps and then makes long-range forecasts based on generated and observed data. We theoretically prove that GenF is able to better balance the forecasting variance and bias, leading to a much smaller forecasting error. We implement GenF via three components: (i) a novel conditional Wasserstein Generative Adversarial Network (GAN) based generator for synthetic time series data generation, called CWGAN-TS. (ii) a transformer based predictor, which makes long-range predictions using both generated and observed data. (iii) an information theoretic clustering algorithm to improve the training of both the CWGAN-TS and the transformer based predictor. The experimental results on five public datasets demonstrate that GenF significantly outperforms a diverse range of state-of-the-art benchmarks and classical approaches. Specifically, we find a 5% - 11% improvement in predictive performance (mean absolute error) while having a 15% - 50% reduction in parameters compared to the benchmarks. Lastly, we conduct an ablation study to further explore and demonstrate the effectiveness of the components comprising GenF.  ( 2 min )

Dataset Distillation (DD), a newly emerging field, aims at generating much smaller and high-quality synthetic datasets from large ones. Existing DD methods based on gradient matching achieve leading performance; however, they are extremely computationally intensive as they require continuously optimizing a dataset among thousands of randomly initialized models. In this paper, we assume that training the synthetic data with diverse models leads to better generalization performance. Thus we propose two \textbf{model augmentation} techniques, ~\ie using \textbf{early-stage models} and \textbf{weight perturbation} to learn an informative synthetic set with significantly reduced training cost. Extensive experiments demonstrate that our method achieves up to 20$\times$ speedup and comparable performance on par with state-of-the-art baseline methods.  ( 2 min )

The importance of learning rate (LR) schedules on network pruning has been observed in a few recent works. As an example, Frankle and Carbin (2019) highlighted that winning tickets (i.e., accuracy preserving subnetworks) can not be found without applying a LR warmup schedule and Renda, Frankle and Carbin (2020) demonstrated that rewinding the LR to its initial state at the end of each pruning cycle improves performance. In this paper, we go one step further by first providing a theoretical justification for the surprising effect of LR schedules. Next, we propose a LR schedule for network pruning called SILO, which stands for S-shaped Improved Learning rate Optimization. The advantages of SILO over existing state-of-the-art (SOTA) LR schedules are two-fold: (i) SILO has a strong theoretical motivation and dynamically adjusts the LR during pruning to improve generalization. Specifically, SILO increases the LR upper bound (max_lr) in an S-shape. This leads to an improvement of 2% - 4% in extensive experiments with various types of networks (e.g., Vision Transformers, ResNet) on popular datasets such as ImageNet, CIFAR-10/100. (ii) In addition to the strong theoretical motivation, SILO is empirically optimal in the sense of matching an Oracle, which exhaustively searches for the optimal value of max_lr via grid search. We find that SILO is able to precisely adjust the value of max_lr to be within the Oracle optimized interval, resulting in performance competitive with the Oracle with significantly lower complexity.  ( 2 min )

The hyperparameter optimization of neural network can be expressed as a bilevel optimization problem. The bilevel optimization is used to automatically update the hyperparameter, and the gradient of the hyperparameter is the approximate gradient based on the best response function. Finding the best response function is very time consuming. In this paper we propose CPMLHO, a new hyperparameter optimization method using cutting plane method and mixed-level objective function.The cutting plane is added to the inner layer to constrain the space of the response function. To obtain more accurate hypergradient,the mixed-level can flexibly adjust the loss function by using the loss of the training set and the verification set. Compared to existing methods, the experimental results show that our method can automatically update the hyperparameters in the training process, and can find more superior hyperparameters with higher accuracy and faster convergence.  ( 2 min )

Mutual Information (MI) based feature selection makes use of MI to evaluate each feature and eventually shortlists a relevant feature subset, in order to address issues associated with high-dimensional datasets. Despite the effectiveness of MI in feature selection, we notice that many state-of-the-art algorithms disregard the so-called unique relevance (UR) of features, and arrive at a suboptimal selected feature subset which contains a non-negligible number of redundant features. We point out that the heart of the problem is that all these MIBFS algorithms follow the criterion of Maximize Relevance with Minimum Redundancy (MRwMR), which does not explicitly target UR. This motivates us to augment the existing criterion with the objective of boosting unique relevance (BUR), leading to a new criterion called MRwMR-BUR. Depending on the task being addressed, MRwMR-BUR has two variants, termed MRwMR-BUR-KSG and MRwMR-BUR-CLF, which estimate UR differently. MRwMR-BUR-KSG estimates UR via a nearest-neighbor based approach called the KSG estimator and is designed for three major tasks: (i) Classification Performance. (ii) Feature Interpretability. (iii) Classifier Generalization. MRwMR-BUR-CLF estimates UR via a classifier based approach. It adapts UR to different classifiers, further improving the competitiveness of MRwMR-BUR for classification performance oriented tasks. The performance of both MRwMR-BUR-KSG and MRwMR-BUR-CLF is validated via experiments using six public datasets and three popular classifiers. Specifically, as compared to MRwMR, the proposed MRwMR-BUR-KSG improves the test accuracy by 2% - 3% with 25% - 30% fewer features being selected, without increasing the algorithm complexity. MRwMR-BUR-CLF further improves the classification performance by 3.8%- 5.5% (relative to MRwMR), and it also outperforms three popular classifier dependent feature selection methods.  ( 2 min )

Despite the tremendous advances in machine learning (ML), training with imbalanced data still poses challenges in many real-world applications. Among a series of diverse techniques to solve this problem, sampling algorithms are regarded as an efficient solution. However, the problem is more fundamental, with many works emphasizing the importance of instance hardness. This issue refers to the significance of managing unsafe or potentially noisy instances that are more likely to be misclassified and serve as the root cause of poor classification performance. This paper introduces HardVis, a visual analytics system designed to handle instance hardness mainly in imbalanced classification scenarios. Our proposed system assists users in visually comparing different distributions of data types, selecting types of instances based on local characteristics that will later be affected by the active sampling method, and validating which suggestions from undersampling or oversampling techniques are beneficial for the ML model. Additionally, rather than uniformly undersampling/oversampling a specific class, we allow users to find and sample easy and difficult to classify training instances from all classes. Users can explore subsets of data from different perspectives to decide all those parameters, while HardVis keeps track of their steps and evaluates the model's predictive performance in a test set separately. The end result is a well-balanced data set that boosts the predictive power of the ML model. The efficacy and effectiveness of HardVis are demonstrated with a hypothetical usage scenario and a use case. Finally, we also look at how useful our system is based on feedback we received from ML experts.  ( 3 min )

In this paper, we propose Wasserstein Isometric Mapping (Wassmap), a nonlinear dimensionality reduction technique that provides solutions to some drawbacks in existing global nonlinear dimensionality reduction algorithms in imaging applications. Wassmap represents images via probability measures in Wasserstein space, then uses pairwise Wasserstein distances between the associated measures to produce a low-dimensional, approximately isometric embedding. We show that the algorithm is able to exactly recover parameters of some image manifolds including those generated by translations or dilations of a fixed generating measure. Additionally, we show that a discrete version of the algorithm retrieves parameters from manifolds generated from discrete measures by providing a theoretical bridge to transfer recovery results from functional data to discrete data. Testing of the proposed algorithms on various image data manifolds show that Wassmap yields good embeddings compared with other global and local techniques.  ( 2 min )

The multi-armed bandit(MAB) problem is a simple yet powerful framework that has been extensively studied in the context of decision-making under uncertainty. In many real-world applications, such as robotic applications, selecting an arm corresponds to a physical action that constrains the choices of the next available arms (actions). Motivated by this, we study an extension of MAB called the graph bandit, where an agent travels over a graph to maximize the reward collected from different nodes. The graph defines the agent's freedom in selecting the next available nodes at each step. We assume the graph structure is fully available, but the reward distributions are unknown. Built upon an offline graph-based planning algorithm and the principle of optimism, we design a learning algorithm, \texttt{G-UCB}, that balances long-term exploration-exploitation using the principle of optimism. We show that our proposed algorithm achieves $O(\sqrt{|S|T\log(T)}+D|S|\log T)$ learning regret, where $|S|$ is the number of nodes and $D$ is the diameter of the graph, which matches the theoretical lower bound $\Omega(\sqrt{|S|T})$ up to logarithmic factors. To our knowledge, this result is among the first tight regret bounds in non-episodic, un-discounted learning problems with known deterministic transitions. Numerical experiments confirm that our algorithm outperforms several benchmarks.  ( 2 min )

The evaluation of clustering algorithms can involve running them on a variety of benchmark problems, and comparing their outputs to the reference, ground-truth groupings provided by experts. Unfortunately, many research papers and graduate theses consider only a small number of datasets. Also, the fact that there can be many equally valid ways to cluster a given problem set is rarely taken into account. In order to overcome these limitations, we have developed a framework whose aim is to introduce a consistent methodology for testing clustering algorithms. Furthermore, we have aggregated, polished, and standardised many clustering benchmark dataset collections referred to across the machine learning and data mining literature, and included new datasets of different dimensionalities, sizes, and cluster types. An interactive datasets explorer, the documentation of the Python API, a description of the ways to interact with the framework from other programming languages such as R or MATLAB, and other details are all provided at .  ( 2 min )

There is a significant need for principled uncertainty reasoning in machine learning systems as they are increasingly deployed in safety-critical domains. A new approach with uncertainty-aware regression-based neural networks (NNs), based on learning evidential distributions for aleatoric and epistemic uncertainties, shows promise over traditional deterministic methods and typical Bayesian NNs, notably with the capabilities to disentangle aleatoric and epistemic uncertainties. Despite some empirical success of Deep Evidential Regression (DER), there are important gaps in the mathematical foundation that raise the question of why the proposed technique seemingly works. We detail the theoretical shortcomings and analyze the performance on synthetic and real-world data sets, showing that Deep Evidential Regression is a heuristic rather than an exact uncertainty quantification. We go on to propose corrections and redefinitions of how aleatoric and epistemic uncertainties should be extracted from NNs.  ( 2 min )

Given independent standard Gaussian points $v_1, \ldots, v_n$ in dimension $d$, for what values of $(n, d)$ does there exist with high probability an origin-symmetric ellipsoid that simultaneously passes through all of the points? This basic problem of fitting an ellipsoid to random points has connections to low-rank matrix decompositions, independent component analysis, and principal component analysis. Based on strong numerical evidence, Saunderson, Parrilo, and Willsky [Proc. of Conference on Decision and Control, pp. 6031-6036, 2013] conjecture that the ellipsoid fitting problem transitions from feasible to infeasible as the number of points $n$ increases, with a sharp threshold at $n \sim d^2/4$. We resolve this conjecture up to logarithmic factors by constructing a fitting ellipsoid for some $n = \Omega( \, d^2/\mathrm{polylog}(d) \,)$, improving prior work of Ghosh et al. [Proc. of Symposium on Foundations of Computer Science, pp. 954-965, 2020] that requires $n = o(d^{3/2})$. Our proof demonstrates feasibility of the least squares construction of Saunderson et al. using a convenient decomposition of a certain non-standard random matrix and a careful analysis of its Neumann expansion via the theory of graph matrices.  ( 2 min )

Risk management in many environmental settings requires an understanding of the mechanisms that drive extreme events. Useful metrics for quantifying such risk are extreme quantiles of response variables conditioned on predictor variables that describe, e.g., climate, biosphere and environmental states. Typically these quantiles lie outside the range of observable data and so, for estimation, require specification of parametric extreme value models within a regression framework. Classical approaches in this context utilise linear or additive relationships between predictor and response variables and suffer in either their predictive capabilities or computational efficiency; moreover, their simplicity is unlikely to capture the truly complex structures that lead to the creation of extreme wildfires. In this paper, we propose a new methodological framework for performing extreme quantile regression using artificial neutral networks, which are able to capture complex non-linear relationships and scale well to high-dimensional data. The ``black box" nature of neural networks means that they lack the desirable trait of interpretability often favoured by practitioners; thus, we unify linear, and additive, regression methodology with deep learning to create partially-interpretable neural networks that can be used for statistical inference but retain high prediction accuracy. To complement this methodology, we further propose a novel point process model for extreme values which overcomes the finite lower-endpoint problem associated with the generalised extreme value class of distributions. Efficacy of our unified framework is illustrated on U.S. wildfire data with a high-dimensional predictor set and we illustrate vast improvements in predictive performance over linear and spline-based regression techniques.  ( 2 min )

Some of the tightest information-theoretic generalization bounds depend on the average information between the learned hypothesis and a single training example. However, these sample-wise bounds were derived only for expected generalization gap. We show that even for expected squared generalization gap no such sample-wise information-theoretic bounds exist. The same is true for PAC-Bayes and single-draw bounds. Remarkably, PAC-Bayes, single-draw and expected squared generalization gap bounds that depend on information in pairs of examples exist.  ( 2 min )

Independent component analysis (ICA) is a blind source separation method to recover source signals of interest from their mixtures. Most existing ICA procedures assume independent sampling. Second-order-statistics-based source separation methods have been developed based on parametric time series models for the mixtures from the autocorrelated sources. However, the second-order-statistics-based methods cannot separate the sources accurately when the sources have temporal autocorrelations with mixed spectra. To address this issue, we propose a new ICA method by estimating spectral density functions and line spectra of the source signals using cubic splines and indicator functions, respectively. The mixed spectra and the mixing matrix are estimated by maximizing the Whittle likelihood function. We illustrate the performance of the proposed method through simulation experiments and an EEG data application. The numerical results indicate that our approach outperforms existing ICA methods, including SOBI algorithms. In addition, we investigate the asymptotic behavior of the proposed method.  ( 2 min )

The hydrodynamic performance of a sea-going ship varies over its lifespan due to factors like marine fouling and the condition of the anti-fouling paint system. In order to accurately estimate the power demand and fuel consumption for a planned voyage, it is important to assess the hydrodynamic performance of the ship. The current work uses machine-learning (ML) methods to estimate the hydrodynamic performance of a ship using the onboard recorded in-service data. Three ML methods, NL-PCR, NL-PLSR and probabilistic ANN, are calibrated using the data from two sister ships. The calibrated models are used to extract the varying trend in ship's hydrodynamic performance over time and predict the change in performance through several propeller and hull cleaning events. The predicted change in performance is compared with the corresponding values estimated using the fouling friction coefficient ($\Delta C_F$). The ML methods are found to be performing well while modelling the hydrodynamic state variables of the ships with probabilistic ANN model performing the best, but the results from NL-PCR and NL-PLSR are not far behind, indicating that it may be possible to use simple methods to solve such problems with the help of domain knowledge.  ( 2 min )

In this paper, we revisit the class of iterative shrinkage-thresholding algorithms (ISTA) for solving the linear inverse problem with sparse representation, which arises in signal and image processing. It is shown in the numerical experiment to deblur an image that the convergence behavior in the logarithmic-scale ordinate tends to be linear instead of logarithmic, approximating to be flat. Making meticulous observations, we find that the previous assumption for the smooth part to be convex weakens the least-square model. Specifically, assuming the smooth part to be strongly convex is more reasonable for the least-square model, even though the image matrix is probably ill-conditioned. Furthermore, we improve the pivotal inequality tighter for composite optimization with the smooth part to be strongly convex instead of general convex, which is first found in [Li et al., 2022]. Based on this pivotal inequality, we generalize the linear convergence to composite optimization in both the objective value and the squared proximal subgradient norm. Meanwhile, we set a simple ill-conditioned matrix which is easy to compute the singular values instead of the original blur matrix. The new numerical experiment shows the proximal generalization of Nesterov's accelerated gradient descent (NAG) for the strongly convex function has a faster linear convergence rate than ISTA. Based on the tighter pivotal inequality, we also generalize the faster linear convergence rate to composite optimization, in both the objective value and the squared proximal subgradient norm, by taking advantage of the well-constructed Lyapunov function with a slight modification and the phase-space representation based on the high-resolution differential equation framework from the implicit-velocity scheme.  ( 2 min )

The estimation of the generalization error of classifiers often relies on a validation set. Such a set is hardly available in few-shot learning scenarios, a highly disregarded shortcoming in the field. In these scenarios, it is common to rely on features extracted from pre-trained neural networks combined with distance-based classifiers such as nearest class mean. In this work, we introduce a Gaussian model of the feature distribution. By estimating the parameters of this model, we are able to predict the generalization error on new classification tasks with few samples. We observe that accurate distance estimates between class-conditional densities are the key to accurate estimates of the generalization performance. Therefore, we propose an unbiased estimator for these distances and integrate it in our numerical analysis. We show that our approach outperforms alternatives such as the leave-one-out cross-validation strategy in few-shot settings.  ( 2 min )

Explicitly accounting for uncertainties is paramount to the safety of engineering structures. Optimization which is often carried out at the early stage of the structural design offers an ideal framework for this task. When the uncertainties are mainly affecting the objective function, robust design optimization is traditionally considered. This work further assumes the existence of multiple and competing objective functions that need to be dealt with simultaneously. The optimization problem is formulated by considering quantiles of the objective functions which allows for the combination of both optimality and robustness in a single metric. By introducing the concept of common random numbers, the resulting nested optimization problem may be solved using a general-purpose solver, herein the non-dominated sorting genetic algorithm (NSGA-II). The computational cost of such an approach is however a serious hurdle to its application in real-world problems. We therefore propose a surrogate-assisted approach using Kriging as an inexpensive approximation of the associated computational model. The proposed approach consists of sequentially carrying out NSGA-II while using an adaptively built Kriging model to estimate the quantiles. Finally, the methodology is adapted to account for mixed categorical-continuous parameters as the applications involve the selection of qualitative design parameters as well. The methodology is first applied to two analytical examples showing its efficiency. The third application relates to the selection of optimal renovation scenarios of a building considering both its life cycle cost and environmental impact. It shows that when it comes to renovation, the heating system replacement should be the priority.  ( 2 min )

A recent line of work has shown remarkable behaviors of the generalization error curves in simple learning models. Even the least-squares regression has shown atypical features such as the model-wise double descent, and further works have observed triple or multiple descents. Another important characteristic are the epoch-wise descent structures which emerge during training. The observations of model-wise and epoch-wise descents have been analytically derived in limited theoretical settings (such as the random feature model) and are otherwise experimental. In this work, we provide a full and unified analysis of the whole time-evolution of the generalization curve, in the asymptotic large-dimensional regime and under gradient-flow, within a wider theoretical setting stemming from a gaussian covariate model. In particular, we cover most cases already disparately observed in the literature, and also provide examples of the existence of multiple descent structures as a function of a model parameter or time. Furthermore, we show that our theoretical predictions adequately match the learning curves obtained by gradient descent over realistic datasets. Technically we compute averages of rational expressions involving random matrices using recent developments in random matrix theory based on "linear pencils". Another contribution, which is also of independent interest in random matrix theory, is a new derivation of related fixed point equations (and an extension there-off) using Dyson brownian motions.  ( 2 min )

We study short-term prediction of wind speed and wind power (every 10 minutes up to 4 hours ahead). Accurate forecasts for these quantities are crucial to mitigate the negative effects of wind farms' intermittent production on energy systems and markets. We use machine learning to combine outputs from numerical weather prediction models with local observations. The former provide valuable information on higher scales dynamics while the latter gives the model fresher and location-specific data. So as to make the results usable for practitioners, we focus on well-known methods which can handle a high volume of data. We study first variable selection using both a linear technique and a nonlinear one. Then we exploit these results to forecast wind speed and wind power still with an emphasis on linear models versus nonlinear ones. For the wind power prediction, we also compare the indirect approach (wind speed predictions passed through a power curve) and the indirect one (directly predict wind power).  ( 2 min )

Multi-player multi-armed bandit is an increasingly relevant decision-making problem, motivated by applications to cognitive radio systems. Most research for this problem focuses exclusively on the settings that players have \textit{full access} to all arms and receive no reward when pulling the same arm. Hence all players solve the same bandit problem with the goal of maximizing their cumulative reward. However, these settings neglect several important factors in many real-world applications, where players have \textit{limited access} to \textit{a dynamic local subset of arms} (i.e., an arm could sometimes be ``walking'' and not accessible to the player). To this end, this paper proposes a \textit{multi-player multi-armed walking bandits} model, aiming to address aforementioned modeling issues. The goal now is to maximize the reward, however, players can only pull arms from the local subset and only collect a full reward if no other players pull the same arm. We adopt Upper Confidence Bound (UCB) to deal with the exploration-exploitation tradeoff and employ distributed optimization techniques to properly handle collisions. By carefully integrating these two techniques, we propose a decentralized algorithm with near-optimal guarantee on the regret, and can be easily implemented to obtain competitive empirical performance.  ( 2 min )

Reinforcement learning (RL) is one of the most vibrant research frontiers in machine learning and has been recently applied to solve a number of challenging problems. In this paper, we primarily focus on off-policy evaluation (OPE), one of the most fundamental topics in RL. In recent years, a number of OPE methods have been developed in the statistics and computer science literature. We provide a discussion on the efficiency bound of OPE, some of the existing state-of-the-art OPE methods, their statistical properties and some other related research directions that are currently actively explored.  ( 2 min )

We propose a novel model agnostic data-driven reliability analysis framework for time-dependent reliability analysis. The proposed approach -- referred to as MAntRA -- combines interpretable machine learning, Bayesian statistics, and identifying stochastic dynamic equation to evaluate reliability of stochastically-excited dynamical systems for which the governing physics is \textit{apriori} unknown. A two-stage approach is adopted: in the first stage, an efficient variational Bayesian equation discovery algorithm is developed to determine the governing physics of an underlying stochastic differential equation (SDE) from measured output data. The developed algorithm is efficient and accounts for epistemic uncertainty due to limited and noisy data, and aleatoric uncertainty because of environmental effect and external excitation. In the second stage, the discovered SDE is solved using a stochastic integration scheme and the probability failure is computed. The efficacy of the proposed approach is illustrated on three numerical examples. The results obtained indicate the possible application of the proposed approach for reliability analysis of in-situ and heritage structures from on-site measurements.  ( 2 min )

The performance of differentially private machine learning can be boosted significantly by leveraging the transfer learning capabilities of non-private models pretrained on large public datasets. We critically review this approach. We primarily question whether the use of large Web-scraped datasets should be viewed as differential-privacy-preserving. We caution that publicizing these models pretrained on Web data as "private" could lead to harm and erode the public's trust in differential privacy as a meaningful definition of privacy. Beyond the privacy considerations of using public data, we further question the utility of this paradigm. We scrutinize whether existing machine learning benchmarks are appropriate for measuring the ability of pretrained models to generalize to sensitive domains, which may be poorly represented in public Web data. Finally, we notice that pretraining has been especially impactful for the largest available models -- models sufficiently large to prohibit end users running them on their own devices. Thus, deploying such models today could be a net loss for privacy, as it would require (private) data to be outsourced to a more compute-powerful third party. We conclude by discussing potential paths forward for the field of private learning, as public pretraining becomes more popular and powerful.  ( 2 min )

Leveraging well-established MCMC strategies, we propose MCMC-interactive variational inference (MIVI) to not only estimate the posterior in a time constrained manner, but also facilitate the design of MCMC transitions. Constructing a variational distribution followed by a short Markov chain that has parameters to learn, MIVI takes advantage of the complementary properties of variational inference and MCMC to encourage mutual improvement. On one hand, with the variational distribution locating high posterior density regions, the Markov chain is optimized within the variational inference framework to efficiently target the posterior despite a small number of transitions. On the other hand, the optimized Markov chain with considerable flexibility guides the variational distribution towards the posterior and alleviates its underestimation of uncertainty. Furthermore, we prove the optimized Markov chain in MIVI admits extrapolation, which means its marginal distribution gets closer to the true posterior as the chain grows. Therefore, the Markov chain can be used separately as an efficient MCMC scheme. Experiments show that MIVI not only accurately and efficiently approximates the posteriors but also facilitates designs of stochastic gradient MCMC and Gibbs sampling transitions.  ( 2 min )

Global pooling is one of the most significant operations in many machine learning models and tasks, which works for information fusion and structured data (like sets and graphs) representation. However, without solid mathematical fundamentals, its practical implementations often depend on empirical mechanisms and thus lead to sub-optimal, even unsatisfactory performance. In this work, we develop a novel and generalized global pooling framework through the lens of optimal transport. The proposed framework is interpretable from the perspective of expectation-maximization. Essentially, it aims at learning an optimal transport across sample indices and feature dimensions, making the corresponding pooling operation maximize the conditional expectation of input data. We demonstrate that most existing pooling methods are equivalent to solving a regularized optimal transport (ROT) problem with different specializations, and more sophisticated pooling operations can be implemented by hierarchically solving multiple ROT problems. Making the parameters of the ROT problem learnable, we develop a family of regularized optimal transport pooling (ROTP) layers. We implement the ROTP layers as a new kind of deep implicit layer. Their model architectures correspond to different optimization algorithms. We test our ROTP layers in several representative set-level machine learning scenarios, including multi-instance learning (MIL), graph classification, graph set representation, and image classification. Experimental results show that applying our ROTP layers can reduce the difficulty of the design and selection of global pooling -- our ROTP layers may either imitate some existing global pooling methods or lead to some new pooling layers fitting data better. The code is available at \url{https://github.com/SDS-Lab/ROT-Pooling}.  ( 2 min )

The performance of decision policies and prediction models often deteriorates when applied to environments different from the ones seen during training. To ensure reliable operation, we propose and analyze the stability of a system under distribution shift, which is defined as the smallest change in the underlying environment that causes the system's performance to deteriorate beyond a permissible threshold. In contrast to standard tail risk measures and distributionally robust losses that require the specification of a plausible magnitude of distribution shift, the stability measure is defined in terms of a more intuitive quantity: the level of acceptable performance degradation. We develop a minimax optimal estimator of stability and analyze its convergence rate, which exhibits a fundamental phase shift behavior. Our characterization of the minimax convergence rate shows that evaluating stability against large performance degradation incurs a statistical cost. Empirically, we demonstrate the practical utility of our stability framework by using it to compare system designs on problems where robustness to distribution shift is critical.  ( 2 min )

Evaluating the performance of an ongoing policy plays a vital role in many areas such as medicine and economics, to provide crucial instruction on the early-stop of the online experiment and timely feedback from the environment. Policy evaluation in online learning thus attracts increasing attention by inferring the mean outcome of the optimal policy (i.e., the value) in real-time. Yet, such a problem is particularly challenging due to the dependent data generated in the online environment, the unknown optimal policy, and the complex exploration and exploitation trade-off in the adaptive experiment. In this paper, we aim to overcome these difficulties in policy evaluation for online learning. We explicitly derive the probability of exploration that quantifies the probability of exploring the non-optimal actions under commonly used bandit algorithms. We use this probability to conduct valid inference on the online conditional mean estimator under each action and develop the doubly robust interval estimation (DREAM) method to infer the value under the estimated optimal policy in online learning. The proposed value estimator provides double protection on the consistency and is asymptotically normal with a Wald-type confidence interval provided. Extensive simulations and real data applications are conducted to demonstrate the empirical validity of the proposed DREAM method.  ( 2 min )

Autoregressive processes naturally arise in a large variety of real-world scenarios, including e.g., stock markets, sell forecasting, weather prediction, advertising, and pricing. When addressing a sequential decision-making problem in such a context, the temporal dependence between consecutive observations should be properly accounted for converge to the optimal decision policy. In this work, we propose a novel online learning setting, named Autoregressive Bandits (ARBs), in which the observed reward follows an autoregressive process of order $k$, whose parameters depend on the action the agent chooses, within a finite set of $n$ actions. Then, we devise an optimistic regret minimization algorithm AutoRegressive Upper Confidence Bounds (AR-UCB) that suffers regret of order $\widetilde{\mathcal{O}} \left( \frac{(k+1)^{3/2}\sqrt{nT}}{(1-\Gamma)^2} \right)$, being $T$ the optimization horizon and $\Gamma < 1$ an index of the stability of the system. Finally, we present a numerical validation in several synthetic and one real-world setting, in comparison with general and specific purpose bandit baselines showing the advantages of the proposed approach.  ( 2 min )

Matrix factorization exploits the idea that, in complex high-dimensional data, the actual signal typically lies in lower-dimensional structures. These lower dimensional objects provide useful insight, with interpretability favored by sparse structures. Sparsity, in addition, is beneficial in terms of regularization and, thus, to avoid over-fitting. By exploiting Bayesian shrinkage priors, we devise a computationally convenient approach for high-dimensional matrix factorization. The dependence between row and column entities is modeled by inducing flexible sparse patterns within factors. The availability of external information is accounted for in such a way that structures are allowed while not imposed. Inspired by boosting algorithms, we pair the the proposed approach with a numerical strategy relying on a sequential inclusion and estimation of low-rank contributions, with data-driven stopping rule. Practical advantages of the proposed approach are demonstrated by means of a simulation study and the analysis of soccer heatmaps obtained from new generation tracking data.  ( 2 min )

submitted by /u/gwern [link] [comments]  ( 55 min )

Why is it that when I go to create a CNN with 4 layers (output channels: 64, 32, 16, 16), I can do this in PyTorch, but in Tensorflow I get resource errors saying I don't have enough resources? For reference I am using a stock NVIDIA RTX 3080. Also, now that I am experimenting with larger models, would I benefit from renting TPU? Does this make the actual models train faster and would it help with larger batches? submitted by /u/Oceanboi [link] [comments]  ( 6 min )

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submitted by /u/Repeat-or [link] [comments]  ( 51 min )

I recently made art for a project that someone bought off me and I want to use the money I earned to get better software. What is high quality software that I can invest in? I know about Dalle-2 and nvidia Canvas, but what else is there? submitted by /u/Giham [link] [comments]  ( 51 min )

My take on ChatGPT from the perspective of a software engineer. It’s amazing, but it won’t replace our jobs (yet). submitted by /u/dhines5 [link] [comments]  ( 54 min )

The magic of human language blinds us 2 its sociobiological humble origins. We could probably speaks 10s of thousands of yrs before leaving evidence and, probably only slightly more sophisticated than dogs initially, and it was just brute force trial and error that lead to Shakespeare. submitted by /u/Emergency_Address_51 [link] [comments]  ( 47 min )

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Hey guys! I made an app where you can chat with the AI-powered digital twin of a real person, it’s called “Get Cheezy With Dr. Aaron Ozee”.Aaron Ozee is a celebrity writer and children’s book author, but also he’s a friend of mine and it was cool to work together to create something so fundamentally new. The avatar is super realistic, he moves, sounds, and talks like Aaron himself, all because AI models, such as TTS, lipsync and the conversational engine based on LLM. Here is an app, if you want to try: https://apps.apple.com/app/get-cheezy-with-dr-aaron-ozee/id1642331303 Next, I want to make a tool where everyone can create their own character and share it with friends and followers. I believe this will revolutionize 1-to-many direct communication. I would love to hear your feedback, do you think this technology can scale our most valuable resource — time? submitted by /u/mynameisJura [link] [comments]  ( 48 min )

Need an teacher? Use ChatGPT Need an designer? Use Midjourney Need an voice actor? Use Synthesis Need a copywriter? Use Copy AI Need an assistant? Use Alexa You can use AI and save thousands of hours. submitted by /u/TheVellerShow [link] [comments]  ( 57 min )

submitted by /u/PuppetHere [link] [comments]  ( 53 min )

Seeing AI do so many wonderful things in no time is beautiful but also scary It is cool to see it replace a profession when you are not from that field but if you are it will leave you without. It can and will do wonderful things but at the rate it is advancing (which will only get faster) most jobs will stop existing, what will people even do for a living when AI can do everything, faster and better? (INB4 universal basic income The goverments don't want to gift you money, they live from you and if they did give you money chances are it would be under some kind of strict social credit slavery that will barely allow you to live (if they outright don't start killing people). Communist utopias always end with everybody owning nothing or being disposable tools of the state. submitted by /u/Absolutelynobody54 [link] [comments]  ( 51 min )

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Programming is way more fun when you learn/work with someone. Help each other, ask questions, brainstorm, etc. There is just so much benefit to joining a community when you are in this field, especially when you cannot find the question you are looking for on stack overflow! 😉 This is the same thing with AI, which is why I created a Discord server two years ago. Where anyone learning or working in the field could come and share their projects, learn together, work together, and much more. The community is now close to 30'000 members, which is unbelievable! Likewise, if you are just tinkering with ChatGPT, DALLE or MidJourney. Come join us and share your creations and the projects/companies/products you build (or find your next co-founder)! So glad to see it growing and see everyone so active. We have partnered with Towards AI to provide qualitative events, live streams, a community newsletter, free courses following recent developments, job opportunities, and more! p.s. we are always looking for contributors to our different projects (answer questions, moderation, help with open-source resources, podcast hosts...). Please reach out to me if interested! We also have some budget or cool merch we can send out :) Come join us if you are in the AI field ! https://discord.gg/learnaitogether submitted by /u/OnlyProggingForFun [link] [comments]  ( 53 min )

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I would like to implement machine learning services for the following propose. verify correctness of answer. verify and correct grammar. look for outdated question (ex: what team Verstapen is racing for?) Desirable: Block offensive questions. I'm open to comment and suggestions! submitted by /u/WillPatagonia [link] [comments]  ( 51 min )

Hey guys, I´m doing a research project on AI Art and I need a lot of artwork from different years all the way from the 1970s to today. Does anyone know how I can find galleries of AI art with the year they were created in? Thanks! submitted by /u/Airikiskul [link] [comments]  ( 55 min )

I use copy.ai to create full articles in minutes and, for now, it is my favourite. However, I would like to explore other options and I would love to read suggestions. submitted by /u/Luisvzoa [link] [comments]  ( 48 min )

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I have several old dell optiplex 7010 machines (core i3) with as much as 8GB RAM each) that I can use, but ZERO knowledge of where to even start. TIA submitted by /u/copycat042 [link] [comments]  ( 49 min )

I'm trying to understand the following breakdown of batch sizes in the realm of high learning rates and fast model training from this post: https://myrtle.ai/learn/how-to-train-your-resnet-2-mini-batches/ Specifically, this bit: The results above suggest that if one wishes to train a neural network at high learning rates then there are two regimes to consider. For the current model and dataset, at batch size 128 we are safely in the regime where forgetfulness dominates and we should either focus on methods to reduce this (e.g. using larger models with sparse updates or perhaps natural gradient descent), or we should push batch sizes higher. At batch size 512 we enter the regime where curvature effects dominate and the focus should shift to mitigating these. In combination with the …  ( 66 min )

Paper: https://arxiv.org/abs/2212.03551 Twitter expanation: https://twitter.com/mpshanahan/status/1601641313933221888 Reddit discussion: https://www.reddit.com/r/agi/comments/zi0ks0/talking_about_large_language_models/ Abstract: Thanks to rapid progress in artificial intelligence, we have entered an era when technology and philosophy intersect in interesting ways. Sitting squarely at the centre of this intersection are large language models (LLMs). The more adept LLMs become at mimicking human language, the more vulnerable we become to anthropomorphism, to seeing the systems in which they are embedded as more human-like than they really are.This trend is amplified by the natural tendency to use philosophically loaded terms, such as "knows", "believes", and "thinks", when describin…  ( 64 min )

so I'm working on a project where multiple sensors relay data to a central node in a synchronous fashion for real time data capture, the main aim being to ensure the data is in sync, all done via BLE. Was wondering how I could use RL to create a control algorithm? Maybe cooperative MARL network where each sensor is the agent or along these lines, or maybe even some other learning algorithm. Would appreciate advice from y'all, previous articles and works are welcome. Thanks!! submitted by /u/TittyMcSwag619 [link] [comments]  ( 63 min )

Another year of has passed, and we’ve seen exciting progress in research around self-supervised learning in computer vision. We’re very excited that some of the recent models such as Masked Autoencoders (MAE) or Masked Siamese Networks (MSN) have been added to our OSS framework. The framework is also more and more used in research, ranging from medical imaging labs to big tech companies. Although we only have limited resources, we’re happy to make at least a small contribution to the community. The framework is built on top of PyTorch and is compatible with frameworks such as PyTorch Lightning for scaling across multiple GPUs.We are curious to hear your feedback. submitted by /u/igorsusmelj [link] [comments]  ( 70 min )

I am trying to recall a recent paper about deep learning activity flow where the authors introduced a penalty term which helps activity flow in the network. The authors show that this helps avoid the vanishing gradient problem and also show that even with poor initialization, they can train well because of their proposed method. ​ The paper proposed an auxiliary loss at the activation level which was able to overcome poor weight initialization and use of sigmoid or tanh activation functions. I have been searching all day and can't find it. I think I originally found it on https://papers.labml.ai/papers/weekly/ submitted by /u/Ok-Teacher-22 [link] [comments]  ( 67 min )

Hello Everyone 👋, I just implemented the paper named AN IMAGE IS WORTH 16X16 WORDS: TRANSFORMERS FOR IMAGE RECOGNITION AT SCALE popularly known as the vision transformer paper. This paper uses a Transformer encoder for image recognition. It achieves state-of-the-art performance without using convolutional layers given that we have a huge dataset and enough computational resources. Below I am sharing my implementation of this paper, please have a look and give it a 🌟 if you like it. This implementation provides easy-to-read code for understanding how the model works internally. My implementation: GitHub Link Thanks for your attention. 😀 submitted by /u/TensorDudee [link] [comments]  ( 69 min )

I am solving a graph-level problem. I want to fit graph embeddings to a learn-to-rank NN to rank the graphs by their "quality". The "quality" of the graphs is determined by whether they have certain shape or structure, say they have self-loops and no loose end, has many split nodes and merging nodes etc. The node and edge features are not in consideration. To my understanding, graph embeddings are best suited for graph similarity comparison, are there any techniques that can fit my use case? submitted by /u/J00Nnn [link] [comments]  ( 58 min )

The standard method is to normalize the entire dataset (the training part) then send it to the model to train on. However I’ve noticed that in this manner the model doesn’t really work well when dealing with values outside the range it was trained on. So how about normalizing each sample between a fixed range, say 0 to 1 and then sending them in. Of course the testing data and the values to predict on would also be normalized in the same way. Would it change the neural network for the better or worse? submitted by /u/xylont [link] [comments]  ( 63 min )

As above. I know there are a deluge of papers out there, but i am looking for a modern but lightweight network that can consume unorganized pt clouds, ideally in batch form (though i am not sure how this will work if points are of different sizes?) and produce 6dof pose, + 3 dof dimensions optionally. I assume it's going to be some kind of lightweight PointNet++ type architecture, but would be great if i can be pointed to some resources submitted by /u/soulslicer0 [link] [comments]  ( 66 min )

If you operate in a country with multiple official languages or across multiple regions, your audio files can contain different languages. Participants may be speaking entirely different languages or may switch between languages. Consider a customer service call to report a problem in an area with a substantial multi-lingual population. Although the conversation could begin […]  ( 6 min )

Enterprises need to translate business-critical content such as marketing materials, instruction manuals, and product catalogs across multiple languages to communicate with a global audience of customers, partners, and stakeholders. Identifying the source language in each document before calling a translate job creates complexities and adds another step to your workflow. For example, an international product […]  ( 5 min )

CAST Visiting Artist Andreas Refsgaard engages the MIT community in the ethics and play of creative coding.  ( 9 min )

Yesterday Terence Tao published a blog post on bounds for the Poisson probability distribution. Specifically, he wrote about Bennett’s inequalities and a refinement that he developed or at least made explicit. Tao writes This observation is not difficult and is implicitly in the literature … I was not able to find a clean version of […] Poisson distribution tail bounds first appeared on John D. Cook.  ( 5 min )

Mentally calculating the day of the week will be especially easy in 2023. The five-step process discussed here reduces to three steps in 2023. One of the steps involves leap years, and 2023 is not a leap year. Another step involves calculating and adding in the “year share,” and the year share for 2023 is […] Mentally calculating the day of the week in 2023 first appeared on John D. Cook.  ( 6 min )

submitted by /u/Ziinxx [link] [comments]  ( 49 min )

The standard method is to normalize the entire dataset (the training part) then send it to the model to train on. However I’ve noticed that in this manner the model doesn’t really work well when dealing with values outside the range it was trained on. So how about normalizing each sample between a fixed range, say 0 to 1 and then sending them in. Of course the testing data and the values to predict on would also be normalized in the same way. Would it change the neural network for the better or worse? submitted by /u/xylont [link] [comments]  ( 65 min )

Hey so I'm working on a project where multiple sensors relay data to a central node in a synchronous fashion for real time data capture, the main aim being to ensure the data is in sync, all done via BLE. Was wondering how I could use RL to create a control algorithm? Maybe cooperative MARL network where each sensor is the agent or along these lines. Would appreciate advice from y'all, previous articles and works are welcome. Thanks!! submitted by /u/TittyMcSwag619 [link] [comments]  ( 50 min )

Hi, I'm new to reinforcement learning (currently reading the Sutton book while trying to create a few things). I'm trying to design a custom environment using OpenAI Gym. Due to the lack of courses, etc., I'm reading the documents to have a deeper understanding of how to design such environments. I came by an example, the so-called gym-any-trade environment. I saw how the developer created this environment using a Pandas dataframe to have the information needed. To me, it seems that each row of the dataframe to be used in this environment contains a time point with stock prices. I wasn't able, however, to see any places in which this code was iterating over the dataframe rows (like a loop "for each row in DF..." or something like that). It only creates a window of observation rows but does not iterate over the rows of the original DF explicitly. So my question is: does the gym-open-air environment iterate over the dataframe rows per default? submitted by /u/tuliosarmento [link] [comments]  ( 56 min )

Self-attentive transformer models have recently been shown to solve the next item recommendation task very efficiently. The learned attention weights capture sequential dynamics in user behavior and generalize well. Motivated by the special structure of learned parameter space, we question if it is possible to mimic it with an alternative and more lightweight approach. We develop a new tensor factorization-based model that ingrains the structural knowledge about sequential data within the learning process. We demonstrate how certain properties of a self-attention network can be reproduced with our approach based on special Hankel matrix representation. The resulting model has a shallow linear architecture and compares competitively to its neural counterpart.  ( 2 min )

SchNetPack is a versatile neural networks toolbox that addresses both the requirements of method development and application of atomistic machine learning. Version 2.0 comes with an improved data pipeline, modules for equivariant neural networks as well as a PyTorch implementation of molecular dynamics. An optional integration with PyTorch Lightning and the Hydra configuration framework powers a flexible command-line interface. This makes SchNetPack 2.0 easily extendable with custom code and ready for complex training task such as generation of 3d molecular structures.  ( 2 min )

High-dimensional data can often display heterogeneity due to heteroscedastic variance or inhomogeneous covariate effects. Penalized quantile and expectile regression methods offer useful tools to detect heteroscedasticity in high-dimensional data. The former is computationally challenging due to the non-smooth nature of the check loss, and the latter is sensitive to heavy-tailed error distributions. In this paper, we propose and study (penalized) robust expectile regression (retire), with a focus on iteratively reweighted $\ell_1$-penalization which reduces the estimation bias from $\ell_1$-penalization and leads to oracle properties. Theoretically, we establish the statistical properties of the retire estimator under two regimes: (i) low-dimensional regime in which $d \ll n$; (ii) high-dimensional regime in which $s\ll n\ll d$ with $s$ denoting the number of significant predictors. In the high-dimensional setting, we carefully characterize the solution path of the iteratively reweighted $\ell_1$-penalized retire estimation, adapted from the local linear approximation algorithm for folded-concave regularization. Under a mild minimum signal strength condition, we show that after as many as $\log(\log d)$ iterations the final iterate enjoys the oracle convergence rate. At each iteration, the weighted $\ell_1$-penalized convex program can be efficiently solved by a semismooth Newton coordinate descent algorithm. Numerical studies demonstrate the competitive performance of the proposed procedure compared with either non-robust or quantile regression based alternatives.  ( 2 min )

This paper first constructs a typical solution of ResNets for multi-category classifications by the principle of gate-network controls and deep-layer classifications, from which a general interpretation of the ResNet architecture is given and the performance mechanism is explained. We then use more solutions to further demonstrate the generality of that interpretation. The universal-approximation capability of ResNets is proved.  ( 2 min )

The geographically weighted regression (GWR) is an essential tool for estimating the spatial variation of relationships between dependent and independent variables in geographical contexts. However, GWR suffers from the problem that classical linear regressions, which compose the GWR model, are more prone to be underfitting, especially for significant volume and complex nonlinear data, causing inferior comparative performance. Nevertheless, some advanced models, such as the decision tree and the support vector machine, can learn features from complex data more effectively while they cannot provide explainable quantification for the spatial variation of localized relationships. To address the above issues, we propose a geographically gradient boosting weighted regression model, GWRBoost, that applies the localized additive model and gradient boosting optimization method to alleviate underfitting problems and retains explainable quantification capability for spatially-varying relationships between geographically located variables. Furthermore, we formulate the computation method of the Akaike information score for the proposed model to conduct the comparative analysis with the classic GWR algorithm. Simulation experiments and the empirical case study are applied to prove the efficient performance and practical value of GWRBoost. The results show that our proposed model can reduce the RMSE by 18.3\% in parameter estimation accuracy and AICc by 67.3\% in the goodness of fit.  ( 2 min )

In many applications, heterogeneous treatment effects on a censored response variable are of primary interest, and it is natural to evaluate the effects at different quantiles (e.g., median). The large number of potential effect modifiers, the unknown structure of the treatment effects, and the presence of right censoring pose significant challenges. In this paper, we develop a hybrid forest approach called Hybrid Censored Quantile Regression Forest (HCQRF) to assess the heterogeneous effects varying with high-dimensional variables. The hybrid estimation approach takes advantage of the random forests and the censored quantile regression. We propose a doubly-weighted estimation procedure that consists of a redistribution-of-mass weight to handle censoring and an adaptive nearest neighbor weight derived from the forest to handle high-dimensional effect functions. We propose a variable importance decomposition to measure the impact of a variable on the treatment effect function. Extensive simulation studies demonstrate the efficacy and stability of HCQRF. The result of the simulation study also convinces us of the effectiveness of the variable importance decomposition. We apply HCQRF to a clinical trial of colorectal cancer. We achieve insightful estimations of the treatment effect and meaningful variable importance results. The result of the variable importance also confirms the necessity of the decomposition.  ( 2 min )

We introduce the XPER (eXplainable PERformance) methodology to measure the specific contribution of the input features to the predictive or economic performance of a model. Our methodology offers several advantages. First, it is both model-agnostic and performance metric-agnostic. Second, XPER is theoretically founded as it is based on Shapley values. Third, the interpretation of the benchmark, which is inherent in any Shapley value decomposition, is meaningful in our context. Fourth, XPER is not plagued by model specification error, as it does not require re-estimating the model. Fifth, it can be implemented either at the model level or at the individual level. In an application based on auto loans, we find that performance can be explained by a surprisingly small number of features. XPER decompositions are rather stable across metrics, yet some feature contributions switch sign across metrics. Our analysis also shows that explaining model forecasts and model performance are two distinct tasks.  ( 2 min )

Continuous-time Markov chains are used to model stochastic systems where transitions can occur at irregular times, e.g., birth-death processes, chemical reaction networks, population dynamics, and gene regulatory networks. We develop a method to learn a continuous-time Markov chain's transition rate functions from fully observed time series. In contrast with existing methods, our method allows for transition rates to depend nonlinearly on both state variables and external covariates. The Gillespie algorithm is used to generate trajectories of stochastic systems where propensity functions (reaction rates) are known. Our method can be viewed as the inverse: given trajectories of a stochastic reaction network, we generate estimates of the propensity functions. While previous methods used linear or log-linear methods to link transition rates to covariates, we use neural networks, increasing the capacity and potential accuracy of learned models. In the chemical context, this enables the method to learn propensity functions from non-mass-action kinetics. We test our method with synthetic data generated from a variety of systems with known transition rates. We show that our method learns these transition rates with considerably more accuracy than log-linear methods, in terms of mean absolute error between ground truth and predicted transition rates. We also demonstrate an application of our methods to open-loop control of a continuous-time Markov chain.  ( 2 min )

To apply federated learning to drug discovery we developed a novel platform in the context of European Innovative Medicines Initiative (IMI) project MELLODDY (grant n{\deg}831472), which was comprised of 10 pharmaceutical companies, academic research labs, large industrial companies and startups. The MELLODDY platform was the first industry-scale platform to enable the creation of a global federated model for drug discovery without sharing the confidential data sets of the individual partners. The federated model was trained on the platform by aggregating the gradients of all contributing partners in a cryptographic, secure way following each training iteration. The platform was deployed on an Amazon Web Services (AWS) multi-account architecture running Kubernetes clusters in private subnets. Organisationally, the roles of the different partners were codified as different rights and permissions on the platform and administrated in a decentralized way. The MELLODDY platform generated new scientific discoveries which are described in a companion paper.

This work proposes a universal and adaptive second-order method for minimizing second-order smooth, convex functions. Our algorithm achieves $O(\sigma / \sqrt{T})$ convergence when the oracle feedback is stochastic with variance $\sigma^2$, and improves its convergence to $O( 1 / T^3)$ with deterministic oracles, where $T$ is the number of iterations. Our method also interpolates these rates without knowing the nature of the oracle apriori, which is enabled by a parameter-free adaptive step-size that is oblivious to the knowledge of smoothness modulus, variance bounds and the diameter of the constrained set. To our knowledge, this is the first universal algorithm with such global guarantees within the second-order optimization literature.

We develop an optimization algorithm suitable for Bayesian learning in complex models. Our approach relies on natural gradient updates within a general black-box framework for efficient training with limited model-specific derivations. It applies within the class of exponential-family variational posterior distributions, for which we extensively discuss the Gaussian case for which the updates have a rather simple form. Our Quasi Black-box Variational Inference (QBVI) framework is readily applicable to a wide class of Bayesian inference problems and is of simple implementation as the updates of the variational posterior do not involve gradients with respect to the model parameters, nor the prescription of the Fisher information matrix. We develop QBVI under different hypotheses for the posterior covariance matrix, discuss details about its robust and feasible implementation, and provide a number of real-world applications to demonstrate its effectiveness.

We derive minimax adaptive rates for a new, broad class of Tikhonov-regularized learning problems in Hilbert scales under general source conditions. Our analysis does not require the regression function to be contained in the hypothesis class, and most notably does not employ the conventional \textit{a priori} assumptions on kernel eigendecay. Using the theory of interpolation, we demonstrate that the spectrum of the Mercer operator can be inferred in the presence of "tight'' $L^{\infty}$ embeddings of suitable Hilbert scales. Our analysis utilizes a new Fourier capacity condition, characterizes the optimal Lorentz range space of a modified Mercer operator in certain parameter regimes.

In supervised learning, it has been shown that label noise in the data can be interpolated without penalties on test accuracy. We show that interpolating label noise induces adversarial vulnerability, and prove the first theorem showing the relationship between label noise and adversarial risk for any data distribution. Our results are almost tight if we do not make any assumptions on the inductive bias of the learning algorithm. We then investigate how different components of this problem affect this result including properties of the distribution. We also discuss non-uniform label noise distributions; and prove a new theorem showing uniform label noise induces nearly as large an adversarial risk as the worst poisoning with the same noise rate. Then, we provide theoretical and empirical evidence that uniform label noise is more harmful than typical real-world label noise. Finally, we show how inductive biases amplify the effect of label noise and argue the need for future work in this direction.

We present a novel approach to probabilistic electricity price forecasting which utilizes distributional neural networks. The model structure is based on a deep neural network that contains a so-called probability layer. The network's output is a parametric distribution with 2 (normal) or 4 (Johnson's SU) parameters. In a forecasting study involving day-ahead electricity prices in the German market, our approach significantly outperforms state-of-the-art benchmarks, including LASSO-estimated regressions and deep neural networks combined with Quantile Regression Averaging. The obtained results not only emphasize the importance of higher moments when modeling volatile electricity prices, but also -- given that probabilistic forecasting is the essence of risk management -- provide important implications for managing portfolios in the power sector.

We generalize the classical universal approximation theorem for neural networks to the case of complex-valued neural networks. Precisely, we consider feedforward networks with a complex activation function $\sigma : \mathbb{C} \to \mathbb{C}$ in which each neuron performs the operation $\mathbb{C}^N \to \mathbb{C}, z \mapsto \sigma(b + w^T z)$ with weights $w \in \mathbb{C}^N$ and a bias $b \in \mathbb{C}$, and with $\sigma$ applied componentwise. We completely characterize those activation functions $\sigma$ for which the associated complex networks have the universal approximation property, meaning that they can uniformly approximate any continuous function on any compact subset of $\mathbb{C}^d$ arbitrarily well. Unlike the classical case of real networks, the set of "good activation functions" which give rise to networks with the universal approximation property differs significantly depending on whether one considers deep networks or shallow networks: For deep networks with at least two hidden layers, the universal approximation property holds as long as $\sigma$ is neither a polynomial, a holomorphic function, or an antiholomorphic function. Shallow networks, on the other hand, are universal if and only if the real part or the imaginary part of $\sigma$ is not a polyharmonic function.

We describe an algorithm that learns two-layer residual units using rectified linear unit (ReLU) activation: suppose the input $\mathbf{x}$ is from a distribution with support space $\mathbb{R}^d$ and the ground-truth generative model is a residual unit of this type, given by $\mathbf{y} = \boldsymbol{B}^\ast\left[\left(\boldsymbol{A}^\ast\mathbf{x}\right)^+ + \mathbf{x}\right]$, where ground-truth network parameters $\boldsymbol{A}^\ast \in \mathbb{R}^{d\times d}$ represent a full-rank matrix with nonnegative entries and $\boldsymbol{B}^\ast \in \mathbb{R}^{m\times d}$ is full-rank with $m \geq d$ and for $\boldsymbol{c} \in \mathbb{R}^d$, $[\boldsymbol{c}^{+}]_i = \max\{0, c_i\}$. We design layer-wise objectives as functionals whose analytic minimizers express the exact ground-truth network in terms of its parameters and nonlinearities. Following this objective landscape, learning residual units from finite samples can be formulated using convex optimization of a nonparametric function: for each layer, we first formulate the corresponding empirical risk minimization (ERM) as a positive semi-definite quadratic program (QP), then we show the solution space of the QP can be equivalently determined by a set of linear inequalities, which can then be efficiently solved by linear programming (LP). We further prove the strong statistical consistency of our algorithm, and demonstrate its robustness and sample efficiency through experimental results on synthetic data and a set of benchmark regression datasets.

While machine learning is traditionally a resource intensive task, embedded systems, autonomous navigation, and the vision of the Internet of Things fuel the interest in resource-efficient approaches. These approaches aim for a carefully chosen trade-off between performance and resource consumption in terms of computation and energy. The development of such approaches is among the major challenges in current machine learning research and key to ensure a smooth transition of machine learning technology from a scientific environment with virtually unlimited computing resources into everyday's applications. In this article, we provide an overview of the current state of the art of machine learning techniques facilitating these real-world requirements. In particular, we focus on deep neural networks (DNNs), the predominant machine learning models of the past decade. We give a comprehensive overview of the vast literature that can be mainly split into three non-mutually exclusive categories: (i) quantized neural networks, (ii) network pruning, and (iii) structural efficiency. These techniques can be applied during training or as post-processing, and they are widely used to reduce the computational demands in terms of memory footprint, inference speed, and energy efficiency. We also briefly discuss different concepts of embedded hardware for DNNs and their compatibility with machine learning techniques as well as potential for energy and latency reduction. We substantiate our discussion with experiments on well-known benchmark datasets using compression techniques (quantization, pruning) for a set of resource-constrained embedded systems, such as CPUs, GPUs and FPGAs. The obtained results highlight the difficulty of finding good trade-offs between resource efficiency and predictive performance.

We study time-inhomogeneous episodic reinforcement learning (RL) under general function approximation and sparse rewards. We design a new algorithm, Variance-weighted Optimistic $Q$-Learning (VO$Q$L), based on $Q$-learning and bound its regret assuming completeness and bounded Eluder dimension for the regression function class. As a special case, VO$Q$L achieves $\tilde{O}(d\sqrt{HT}+d^6H^{5})$ regret over $T$ episodes for a horizon $H$ MDP under ($d$-dimensional) linear function approximation, which is asymptotically optimal. Our algorithm incorporates weighted regression-based upper and lower bounds on the optimal value function to obtain this improved regret. The algorithm is computationally efficient given a regression oracle over the function class, making this the first computationally tractable and statistically optimal approach for linear MDPs.

We propose a principled way to define Gaussian process priors on various sets of unweighted graphs: directed or undirected, with or without loops. We endow each of these sets with a geometric structure, inducing the notions of closeness and symmetries, by turning them into a vertex set of an appropriate metagraph. Building on this, we describe the class of priors that respect this structure and are analogous to the Euclidean isotropic processes, like squared exponential or Mat\'ern. We propose an efficient computational technique for the ostensibly intractable problem of evaluating these priors' kernels, making such Gaussian processes usable within the usual toolboxes and downstream applications. We go further to consider sets of equivalence classes of unweighted graphs and define the appropriate versions of priors thereon. We prove a hardness result, showing that in this case, exact kernel computation cannot be performed efficiently. However, we propose a simple Monte Carlo approximation for handling moderately sized cases. Inspired by applications in chemistry, we illustrate the proposed techniques on a real molecular property prediction task in the small data regime.

How can we perform efficient inference and learning in directed probabilistic models, in the presence of continuous latent variables with intractable posterior distributions, and large datasets? We introduce a stochastic variational inference and learning algorithm that scales to large datasets and, under some mild differentiability conditions, even works in the intractable case. Our contributions are two-fold. First, we show that a reparameterization of the variational lower bound yields a lower bound estimator that can be straightforwardly optimized using standard stochastic gradient methods. Second, we show that for i.i.d. datasets with continuous latent variables per datapoint, posterior inference can be made especially efficient by fitting an approximate inference model (also called a recognition model) to the intractable posterior using the proposed lower bound estimator. Theoretical advantages are reflected in experimental results.

This work proposes the continuous conditional generative adversarial network (CcGAN), the first generative model for image generation conditional on continuous, scalar conditions (termed regression labels). Existing conditional GANs (cGANs) are mainly designed for categorical conditions (eg, class labels); conditioning on regression labels is mathematically distinct and raises two fundamental problems:(P1) Since there may be very few (even zero) real images for some regression labels, minimizing existing empirical versions of cGAN losses (aka empirical cGAN losses) often fails in practice;(P2) Since regression labels are scalar and infinitely many, conventional label input methods are not applicable. The proposed CcGAN solves the above problems, respectively, by (S1) reformulating existing empirical cGAN losses to be appropriate for the continuous scenario; and (S2) proposing a naive label input (NLI) method and an improved label input (ILI) method to incorporate regression labels into the generator and the discriminator. The reformulation in (S1) leads to two novel empirical discriminator losses, termed the hard vicinal discriminator loss (HVDL) and the soft vicinal discriminator loss (SVDL) respectively, and a novel empirical generator loss. The error bounds of a discriminator trained with HVDL and SVDL are derived under mild assumptions in this work. Two new benchmark datasets (RC-49 and Cell-200) and a novel evaluation metric (Sliding Fr\'echet Inception Distance) are also proposed for this continuous scenario. Our experiments on the Circular 2-D Gaussians, RC-49, UTKFace, Cell-200, and Steering Angle datasets show that CcGAN is able to generate diverse, high-quality samples from the image distribution conditional on a given regression label. Moreover, in these experiments, CcGAN substantially outperforms cGAN both visually and quantitatively.

Causal discovery for quantitative data has been extensively studied but less is known for categorical data. We propose a novel causal model for categorical data based on a new classification model, termed classification with optimal label permutation (COLP). By design, COLP is a parsimonious classifier, which gives rise to a provably identifiable causal model. A simple learning algorithm via comparing likelihood functions of causal and anti-causal models suffices to learn the causal direction. Through experiments with synthetic and real data, we demonstrate the favorable performance of the proposed COLP-based causal model compared to state-of-the-art methods. We also make available an accompanying R package COLP, which contains the proposed causal discovery algorithm and a benchmark dataset of categorical cause-effect pairs.

At eBay, there are thousands of product health metrics for different domain teams to monitor. We built a two-phase alerting system to notify users with actionable alerts based on anomaly detection and alert retrieval. In the first phase, we developed an efficient anomaly detection algorithm, called Moving Metric Detector (MMD), to identify potential alerts among metrics with distribution agnostic criteria. In the second alert retrieval phase, we built additional logic with feedbacks to select valid actionable alerts with point-wise ranking model and business rules. Compared with other trend and seasonality decomposition methods, our decomposer is faster and better to detect anomalies in unsupervised cases. Our two-phase approach dramatically improves alert precision and avoids alert spamming in eBay production.

Although understanding and characterizing causal effects have become essential in observational studies, it is challenging when the confounders are high-dimensional. In this article, we develop a general framework $\textit{CausalEGM}$ for estimating causal effects by encoding generative modeling, which can be applied in both binary and continuous treatment settings. Under the potential outcome framework with unconfoundedness, we establish a bidirectional transformation between the high-dimensional confounders space and a low-dimensional latent space where the density is known (e.g., multivariate normal distribution). Through this, CausalEGM simultaneously decouples the dependencies of confounders on both treatment and outcome and maps the confounders to the low-dimensional latent space. By conditioning on the low-dimensional latent features, CausalEGM can estimate the causal effect for each individual or the average causal effect within a population. Our theoretical analysis shows that the excess risk for CausalEGM can be bounded through empirical process theory. Under an assumption on encoder-decoder networks, the consistency of the estimate can be guaranteed. In a series of experiments, CausalEGM demonstrates superior performance over existing methods for both binary and continuous treatments. Specifically, we find CausalEGM to be substantially more powerful than competing methods in the presence of large sample sizes and high dimensional confounders. The software of CausalEGM is freely available at https://github.com/SUwonglab/CausalEGM.

Despite the significant interest and progress in reinforcement learning (RL) problems with adversarial corruption, current works are either confined to the linear setting or lead to an undesired $\tilde{O}(\sqrt{T}\zeta)$ regret bound, where $T$ is the number of rounds and $\zeta$ is the total amount of corruption. In this paper, we consider the contextual bandit with general function approximation and propose a computationally efficient algorithm to achieve a regret of $\tilde{O}(\sqrt{T}+\zeta)$. The proposed algorithm relies on the recently developed uncertainty-weighted least-squares regression from linear contextual bandit \citep{he2022nearly} and a new weighted estimator of uncertainty for the general function class. In contrast to the existing analysis that heavily relies on the linear structure, we develop a novel technique to control the sum of weighted uncertainty, thus establishing the final regret bounds. We then generalize our algorithm to the episodic MDP setting and first achieve an additive dependence on the corruption level $\zeta$ in the scenario of general function approximation. Notably, our algorithms achieve regret bounds either nearly match the performance lower bound or improve the existing methods for all the corruption levels and in both known and unknown $\zeta$ cases.

We study reinforcement learning (RL) with linear function approximation. For episodic time-inhomogeneous linear Markov decision processes (linear MDPs) whose transition dynamic can be parameterized as a linear function of a given feature mapping, we propose the first computationally efficient algorithm that achieves the nearly minimax optimal regret $\tilde O(d\sqrt{H^3K})$, where $d$ is the dimension of the feature mapping, $H$ is the planning horizon, and $K$ is the number of episodes. Our algorithm is based on a weighted linear regression scheme with a carefully designed weight, which depends on a new variance estimator that (1) directly estimates the variance of the \emph{optimal} value function, (2) monotonically decreases with respect to the number of episodes to ensure a better estimation accuracy, and (3) uses a rare-switching policy to update the value function estimator to control the complexity of the estimated value function class. Our work provides a complete answer to optimal RL with linear MDPs, and the developed algorithm and theoretical tools may be of independent interest.

Mapping between discrete and continuous distributions is a difficult task and many have had to resort to heuristical approaches. We propose a tessellation-based approach that directly learns quantization boundaries in a continuous space, complete with exact likelihood evaluations. This is done through constructing normalizing flows on convex polytopes parameterized using a simple homeomorphism with an efficient log determinant Jacobian. We explore this approach in two application settings, mapping from discrete to continuous and vice versa. Firstly, a Voronoi dequantization allows automatically learning quantization boundaries in a multidimensional space. The location of boundaries and distances between regions can encode useful structural relations between the quantized discrete values. Secondly, a Voronoi mixture model has near-constant computation cost for likelihood evaluation regardless of the number of mixture components. Empirically, we show improvements over existing methods across a range of structured data modalities.

Spectral risk objectives - also called $L$-risks - allow for learning systems to interpolate between optimizing average-case performance (as in empirical risk minimization) and worst-case performance on a task. We develop stochastic algorithms to optimize these quantities by characterizing their subdifferential and addressing challenges such as biasedness of subgradient estimates and non-smoothness of the objective. We show theoretically and experimentally that out-of-the-box approaches such as stochastic subgradient and dual averaging are hindered by bias and that our approach outperforms them.

This paper provides estimation and inference methods for an identified set's boundary (i.e., support function) where the selection among a very large number of covariates is based on modern regularized tools. I characterize the boundary using a semiparametric moment equation. Combining Neyman-orthogonality and sample splitting ideas, I construct a root-N consistent, uniformly asymptotically Gaussian estimator of the boundary and propose a multiplier bootstrap procedure to conduct inference. I apply this result to the partially linear model, the partially linear IV model and the average partial derivative with an interval-valued outcome.

The spectra of random feature matrices provide essential information on the conditioning of the linear system used in random feature regression problems and are thus connected to the consistency and generalization of random feature models. Random feature matrices are asymmetric rectangular nonlinear matrices depending on two input variables, the data and the weights, which can make their characterization challenging. We consider two settings for the two input variables, either both are random variables or one is a random variable and the other is well-separated, i.e. there is a minimum distance between points. With conditions on the dimension, the complexity ratio, and the sampling variance, we show that the singular values of these matrices concentrate near their full expectation and near one with high-probability. In particular, since the dimension depends only on the logarithm of the number of random weights or the number of data points, our complexity bounds can be achieved even in moderate dimensions for many practical setting. The theoretical results are verified with numerical experiments.

Despite the empirical successes of self-supervised learning (SSL) methods, it is unclear what characteristics of their representations lead to high downstream accuracies. In this work, we characterize properties that SSL representations should ideally satisfy. Specifically, we prove necessary and sufficient conditions such that for any task invariant to given data augmentations, desired probes (e.g., linear or MLP) trained on that representation attain perfect accuracy. These requirements lead to a unifying conceptual framework for improving existing SSL methods and deriving new ones. For contrastive learning, our framework prescribes simple but significant improvements to previous methods such as using asymmetric projection heads. For non-contrastive learning, we use our framework to derive a simple and novel objective. Our resulting SSL algorithms outperform baselines on standard benchmarks, including SwAV+multicrops on linear probing of ImageNet.

Automated decision support systems promise to help human experts solve tasks more efficiently and accurately. However, existing systems typically require experts to understand when to cede agency to the system or when to exercise their own agency. Moreover, if the experts develop a misplaced trust in the system, their performance may worsen. In this work, we lift the above requirement and develop automated decision support systems that, by design, do not require experts to understand when each of their recommendations is accurate to improve their performance. To this end, we focus on multiclass classification tasks and consider an automated decision support system that, for each data sample, uses a classifier to recommend a subset of labels to a human expert. We first show that, by looking at the design of such a system from the perspective of conformal prediction, we can ensure that the probability that the recommended subset of labels contains the true label matches almost exactly a target probability value with high probability. Then, we develop an efficient and near-optimal search method to find the target probability value under which the expert benefits the most from using our system. Experiments on synthetic and real data demonstrate that our system can help the experts make more accurate predictions and is robust to the accuracy of the classifier it relies on.

This paper presents SVAM (Sequential Variance-Altered MLE), a unified framework for learning generalized linear models under adversarial label corruption in training data. SVAM extends to tasks such as least squares regression, logistic regression, and gamma regression, whereas many existing works on learning with label corruptions focus only on least squares regression. SVAM is based on a novel variance reduction technique that may be of independent interest and works by iteratively solving weighted MLEs over variance-altered versions of the GLM objective. SVAM offers provable model recovery guarantees superior to the state-of-the-art for robust regression even when a constant fraction of training labels are adversarially corrupted. SVAM also empirically outperforms several existing problem-specific techniques for robust regression and classification. Code for SVAM is available at https://github.com/purushottamkar/svam/

Bayesian optimization (BO) is one of the most effective methods for closed-loop experimental design and black-box optimization. However, a key limitation of BO is that it is an inherently sequential algorithm (one experiment is proposed per round) and thus cannot directly exploit high-throughput (parallel) experiments. Diverse modifications to the BO framework have been proposed in the literature to enable exploitation of parallel experiments but such approaches are limited in the degree of parallelization that they can achieve and can lead to redundant experiments (thus wasting resources and potentially compromising performance). In this work, we present new parallel BO paradigms that exploit the structure of the system to partition the design space. Specifically, we propose an approach that partitions the design space by following the level sets of the performance function and an approach that exploits partially-separable structures of the performance function found. We conduct extensive numerical experiments using a reactor case study to benchmark the effectiveness of these approaches against a variety of state-of-the-art parallel algorithms reported in the literature. Our computational results show that our approaches significantly reduce the required search time and increase the probability of finding a global (rather than local) solution.

While the interaction of ultra-intense ultra-short laser pulses with near- and overcritical plasmas cannot be directly observed, experimentally accessible quantities (observables) often only indirectly give information about the underlying plasma dynamics. Furthermore, the information provided by observables is incomplete, making the inverse problem highly ambiguous. Therefore, in order to infer plasma dynamics as well as experimental parameter, the full distribution over parameters given an observation needs to considered, requiring that models are flexible and account for the information lost in the forward process. Invertible Neural Networks (INNs) have been designed to efficiently model both the forward and inverse process, providing the full conditional posterior given a specific measurement. In this work, we benchmark INNs and standard statistical methods on synthetic electron spectra. First, we provide experimental results with respect to the acceptance rate, where our results show increases in acceptance rates up to a factor of 10. Additionally, we show that this increased acceptance rate also results in an increased speed-up for INNs to the same extent. Lastly, we propose a composite algorithm that utilizes INNs and promises low runtimes while preserving high accuracy.

The notion of a Moreau envelope is central to the analysis of first-order optimization algorithms for machine learning. Yet, it has not been developed and extended to be applied to a deep network and, more broadly, to a machine learning system with a differentiable programming implementation. We define a compositional calculus adapted to Moreau envelopes and show how to integrate it within differentiable programming. The proposed framework casts in a mathematical optimization framework several variants of gradient back-propagation related to the idea of the propagation of virtual targets.

Estimating the causal effects of a spatially-varying intervention on a spatially-varying outcome may be subject to non-local confounding (NLC), a phenomenon that can bias estimates when the treatments and outcomes of a given unit are dictated in part by the covariates of other nearby units. In particular, NLC is a challenge for evaluating the effects of environmental policies and climate events on health-related outcomes such as air pollution exposure. This paper first formalizes NLC using the potential outcomes framework, providing a comparison with the related phenomenon of causal interference. Then, it proposes a broadly applicable framework, termed "weather2vec", that uses the theory of balancing scores to learn representations of non-local information into a scalar or vector defined for each observational unit, which is subsequently used to adjust for confounding in conjunction with causal inference methods. The framework is evaluated in a simulation study and two case studies on air pollution where the weather is an (inherently regional) known confounder.

The viral load of patients infected with SARS-CoV-2 varies on logarithmic scales and possibly with age. Controversial claims have been made in the literature regarding whether the viral load distribution actually depends on the age of the patients. Such a dependence would have implications for the COVID-19 spreading mechanism, the age-dependent immune system reaction, and thus for policymaking. We hereby develop a method to analyze viral-load distribution data as a function of the patients' age within a flexible, non-parametric, hierarchical, Bayesian, and causal model. The causal nature of the developed reconstruction additionally allows to test for bias in the data. This could be due to, e.g., bias in patient-testing and data collection or systematic errors in the measurement of the viral load. We perform these tests by calculating the Bayesian evidence for each implied possible causal direction. The possibility of testing for bias in data collection and identifying causal directions can be very useful in other contexts as well. For this reason we make our model freely available. When applied to publicly available age and SARS-CoV-2 viral load data, we find a statistically significant increase in the viral load with age, but only for one of the two analyzed datasets. If we consider this dataset, and based on the current understanding of viral load's impact on patients' infectivity, we expect a non-negligible difference in the infectivity of different age groups. This difference is nonetheless too small to justify considering any age group as noninfectious.

We derive minimax testing errors in a distributed framework where the data is split over multiple machines and their communication to a central machine is limited to $b$ bits. We investigate both the $d$- and infinite-dimensional signal detection problem under Gaussian white noise. We also derive distributed testing algorithms reaching the theoretical lower bounds. Our results show that distributed testing is subject to fundamentally different phenomena that are not observed in distributed estimation. Among our findings, we show that testing protocols that have access to shared randomness can perform strictly better in some regimes than those that do not. We also observe that consistent nonparametric distributed testing is always possible, even with as little as $1$-bit of communication and the corresponding test outperforms the best local test using only the information available at a single local machine. Furthermore, we also derive adaptive nonparametric distributed testing strategies and the corresponding theoretical lower bounds.

Particle dynamics and multi-agent systems provide accurate dynamical models for studying and forecasting the behavior of complex interacting systems. They often take the form of a high-dimensional system of differential equations parameterized by an interaction kernel that models the underlying attractive or repulsive forces between agents. We consider the problem of constructing a data-based approximation of the interacting forces directly from noisy observations of the paths of the agents in time. The learned interaction kernels are then used to predict the agents behavior over a longer time interval. The approximation developed in this work uses a randomized feature algorithm and a sparse randomized feature approach. Sparsity-promoting regression provides a mechanism for pruning the randomly generated features which was observed to be beneficial when one has limited data, in particular, leading to less overfitting than other approaches. In addition, imposing sparsity reduces the kernel evaluation cost which significantly lowers the simulation cost for forecasting the multi-agent systems. Our method is applied to various examples, including first-order systems with homogeneous and heterogeneous interactions, second order homogeneous systems, and a new sheep swarming system.

In the classical setting of self-selection, the goal is to learn $k$ models, simultaneously from observations $(x^{(i)}, y^{(i)})$ where $y^{(i)}$ is the output of one of $k$ underlying models on input $x^{(i)}$. In contrast to mixture models, where we observe the output of a randomly selected model, here the observed model depends on the outputs themselves, and is determined by some known selection criterion. For example, we might observe the highest output, the smallest output, or the median output of the $k$ models. In known-index self-selection, the identity of the observed model output is observable; in unknown-index self-selection, it is not. Self-selection has a long history in Econometrics and applications in various theoretical and applied fields, including treatment effect estimation, imitation learning, learning from strategically reported data, and learning from markets at disequilibrium. In this work, we present the first computationally and statistically efficient estimation algorithms for the most standard setting of this problem where the models are linear. In the known-index case, we require poly$(1/\varepsilon, k, d)$ sample and time complexity to estimate all model parameters to accuracy $\varepsilon$ in $d$ dimensions, and can accommodate quite general selection criteria. In the more challenging unknown-index case, even the identifiability of the linear models (from infinitely many samples) was not known. We show three results in this case for the commonly studied $\max$ self-selection criterion: (1) we show that the linear models are indeed identifiable, (2) for general $k$ we provide an algorithm with poly$(d) \exp(\text{poly}(k))$ sample and time complexity to estimate the regression parameters up to error $1/\text{poly}(k)$, and (3) for $k = 2$ we provide an algorithm for any error $\varepsilon$ and poly$(d, 1/\varepsilon)$ sample and time complexity.

Remaining Useful Life (RUL) estimation plays a critical role in Prognostics and Health Management (PHM). Traditional machine health maintenance systems are often costly, requiring sufficient prior expertise, and are difficult to fit into highly complex and changing industrial scenarios. With the widespread deployment of sensors on industrial equipment, building the Industrial Internet of Things (IIoT) to interconnect these devices has become an inexorable trend in the development of the digital factory. Using the device's real-time operational data collected by IIoT to get the estimated RUL through the RUL prediction algorithm, the PHM system can develop proactive maintenance measures for the device, thus, reducing maintenance costs and decreasing failure times during operation. This paper carries out research into the remaining useful life prediction model for multi-sensor devices in the IIoT scenario. We investigated the mainstream RUL prediction models and summarized the basic steps of RUL prediction modeling in this scenario. On this basis, a data-driven approach for RUL estimation is proposed in this paper. It employs a Multi-Head Attention Mechanism to fuse the multi-dimensional time-series data output from multiple sensors, in which the attention on features is used to capture the interactions between features and attention on sequences is used to learn the weights of time steps. Then, the Long Short-Term Memory Network is applied to learn the features of time series. We evaluate the proposed model on two benchmark datasets (C-MAPSS and PHM08), and the results demonstrate that it outperforms the state-of-art models. Moreover, through the interpretability of the multi-head attention mechanism, the proposed model can provide a preliminary explanation of engine degradation. Therefore, this approach is promising for predictive maintenance in IIoT scenarios.

We consider resource management problems in multi-user wireless networks, which can be cast as optimizing a network-wide utility function, subject to constraints on the long-term average performance of users across the network. We propose a state-augmented algorithm for solving the aforementioned radio resource management (RRM) problems, where, alongside the instantaneous network state, the RRM policy takes as input the set of dual variables corresponding to the constraints, which evolve depending on how much the constraints are violated during execution. We theoretically show that the proposed state-augmented algorithm leads to feasible and near-optimal RRM decisions. Moreover, focusing on the problem of wireless power control using graph neural network (GNN) parameterizations, we demonstrate the superiority of the proposed RRM algorithm over baseline methods across a suite of numerical experiments.

Estimating information-theoretic quantities such as entropy and mutual information is central to many problems in statistics and machine learning, but challenging in high dimensions. This paper presents estimators of entropy via inference (EEVI), which deliver upper and lower bounds on many information quantities for arbitrary variables in a probabilistic generative model. These estimators use importance sampling with proposal distribution families that include amortized variational inference and sequential Monte Carlo, which can be tailored to the target model and used to squeeze true information values with high accuracy. We present several theoretical properties of EEVI and demonstrate scalability and efficacy on two problems from the medical domain: (i) in an expert system for diagnosing liver disorders, we rank medical tests according to how informative they are about latent diseases, given a pattern of observed symptoms and patient attributes; and (ii) in a differential equation model of carbohydrate metabolism, we find optimal times to take blood glucose measurements that maximize information about a diabetic patient's insulin sensitivity, given their meal and medication schedule.

We propose a semiparametric test to evaluate (i) whether different instruments induce subpopulations of compliers with the same observable characteristics on average, and (ii) whether compliers have observable characteristics that are the same as the full population on average. The test is a flexible robustness check for the external validity of instruments. We use it to reinterpret the difference in LATE estimates that Angrist and Evans (1998) obtain when using different instrumental variables. To justify the test, we characterize the doubly robust moment for Abadie (2003)'s class of complier parameters, and we analyze a machine learning update to $\kappa$ weighting.

The theoretical advances on the properties of scoring rules over the past decades have broadened the use of scoring rules in probabilistic forecasting. In meteorological forecasting, statistical postprocessing techniques are essential to improve the forecasts made by deterministic physical models. Numerous state-of-the-art statistical postprocessing techniques are based on distributional regression evaluated with the Continuous Ranked Probability Score (CRPS). However, theoretical properties of such evaluation with the CRPS have solely considered the unconditional framework (i.e. without covariates) and infinite sample sizes. We extend these results and study the rate of convergence in terms of CRPS of distributional regression methods. We find the optimal minimax rate of convergence for a given class of distributions and show that the k-nearest neighbor method and the kernel method reach this optimal minimax rate.

This paper provides theoretical insights into why and how deep learning can generalize well, despite its large capacity, complexity, possible algorithmic instability, nonrobustness, and sharp minima, responding to an open question in the literature. We also discuss approaches to provide non-vacuous generalization guarantees for deep learning. Based on theoretical observations, we propose new open problems and discuss the limitations of our results.

Neural networks are becoming increasingly popular in applications, but our mathematical understanding of their potential and limitations is still limited. In this paper, we further this understanding by developing statistical guarantees for sparse deep learning. In contrast to previous work, we consider different types of sparsity, such as few active connections, few active nodes, and other norm-based types of sparsity. Moreover, our theories cover important aspects that previous theories have neglected, such as multiple outputs, regularization, and l2-loss. The guarantees have a mild dependence on network widths and depths, which means that they support the application of sparse but wide and deep networks from a statistical perspective. Some of the concepts and tools that we use in our derivations are uncommon in deep learning and, hence, might be of additional interest.

Automated rule checking (ARC), which is expected to promote the efficiency of the compliance checking process in the architecture, engineering, and construction (AEC) industry, is gaining increasing attention. Throwing light on the ARC application hotspots and forecasting its trends are useful to the related research and drive innovations. Therefore, this study takes the patents from the database of the Derwent Innovations Index database (DII) and China national knowledge infrastructure (CNKI) as data sources and then carried out a three-step analysis including (1) quantitative characteristics (i.e., annual distribution analysis) of patents, (2) identification of ARC topics using a latent Dirichlet allocation (LDA) and, (3) SNA-based co-occurrence analysis of ARC topics. The results show that the research hotspots and trends of Chinese and English patents are different. The contributions of this study have three aspects: (1) an approach to a comprehensive analysis of patents by integrating multiple text mining methods (i.e., SNA and LDA) is introduced ; (2) the application hotspots and development trends of ARC are reviewed based on patent analysis; and (3) a signpost for technological development and innovation of ARC is provided.

Current research on users` perspectives of cyber security and privacy related to traditional and smart devices at home is very active, but the focus is often more on specific modern devices such as mobile and smart IoT devices in a home context. In addition, most were based on smaller-scale empirical studies such as online surveys and interviews. We endeavour to fill these research gaps by conducting a larger-scale study based on a real-world dataset of 413,985 tweets posted by non-expert users on Twitter in six months of three consecutive years (January and February in 2019, 2020 and 2021). Two machine learning-based classifiers were developed to identify the 413,985 tweets. We analysed this dataset to understand non-expert users` cyber security and privacy perspectives, including the yearly trend and the impact of the COVID-19 pandemic. We applied topic modelling, sentiment analysis and qualitative analysis of selected tweets in the dataset, leading to various interesting findings. For instance, we observed a 54% increase in non-expert users` tweets on cyber security and/or privacy related topics in 2021, compared to before the start of global COVID-19 lockdowns (January 2019 to February 2020). We also observed an increased level of help-seeking tweets during the COVID-19 pandemic. Our analysis revealed a diverse range of topics discussed by non-expert users across the three years, including VPNs, Wi-Fi, smartphones, laptops, smart home devices, financial security, and security and privacy issues involving different stakeholders. Overall negative sentiment was observed across almost all topics non-expert users discussed on Twitter in all the three years. Our results confirm the multi-faceted nature of non-expert users` perspectives on cyber security and privacy and call for more holistic, comprehensive and nuanced research on different facets of such perspectives.

We apply reinforcement learning (RL) to robotics. One of the drawbacks of traditional RL algorithms has been their poor sample efficiency. One approach to improve the sample efficiency is model-based RL. In our model-based RL algorithm, we learn a model of the environment, use it to generate imaginary trajectories and backpropagate through them to update the policy, exploiting the differentiability of the model. Intuitively, learning more accurate models should lead to better performance. Recently, there has been growing interest in developing better deep neural network based dynamics models for physical systems, through better inductive biases. We focus on robotic systems undergoing rigid body motion. We compare two versions of our model-based RL algorithm, one which uses a standard deep neural network based dynamics model and the other which uses a much more accurate, physics-informed neural network based dynamics model. We show that, in model-based RL, model accuracy mainly matters in environments that are sensitive to initial conditions. In these environments, the physics-informed version of our algorithm achieves significantly better average-return and sample efficiency. In environments that are not sensitive to initial conditions, both versions of our algorithm achieve similar average-return, while the physics-informed version achieves better sample efficiency. We measure the sensitivity to initial conditions using the finite-time maximal Lyapunov exponent. We also show that, in challenging environments, where we need a lot of samples to learn, physics-informed model-based RL can achieve better average-return than state-of-the-art model-free RL algorithms such as Soft Actor-Critic, by generating accurate imaginary data.

Despite a surge of recent advances in promoting machine Learning (ML) fairness, the existing mainstream approaches mostly require retraining or finetuning the entire weights of the neural network to meet the fairness criteria. However, this is often infeasible in practice for those large-scale trained models due to large computational and storage costs, low data efficiency, and model privacy issues. In this paper, we propose a new generic fairness learning paradigm, called FairReprogram, which incorporates the model reprogramming technique. Specifically, FairReprogram considers the case where models can not be changed and appends to the input a set of perturbations, called the fairness trigger, which is tuned towards the fairness criteria under a min-max formulation. We further introduce an information-theoretic framework that explains why and under what conditions fairness goals can be achieved using the fairness trigger. We show both theoretically and empirically that the fairness trigger can effectively obscure demographic biases in the output prediction of fixed ML models by providing false demographic information that hinders the model from utilizing the correct demographic information to make the prediction. Extensive experiments on both NLP and CV datasets demonstrate that our method can achieve better fairness improvements than retraining-based methods with far less data dependency under two widely-used fairness criteria. Codes are available at https://github.com/UCSB-NLP-Chang/Fairness-Reprogramming.git.

This work proposes a universal and adaptive second-order method for minimizing second-order smooth, convex functions. Our algorithm achieves $O(\sigma / \sqrt{T})$ convergence when the oracle feedback is stochastic with variance $\sigma^2$, and improves its convergence to $O( 1 / T^3)$ with deterministic oracles, where $T$ is the number of iterations. Our method also interpolates these rates without knowing the nature of the oracle apriori, which is enabled by a parameter-free adaptive step-size that is oblivious to the knowledge of smoothness modulus, variance bounds and the diameter of the constrained set. To our knowledge, this is the first universal algorithm with such global guarantees within the second-order optimization literature.

Transformer networks have seen great success in natural language processing and machine vision, where task objectives such as next word prediction and image classification benefit from nuanced context sensitivity across high-dimensional inputs. However, there is an ongoing debate about how and when transformers can acquire highly structured behavior and achieve systematic generalization. Here, we explore how well a causal transformer can perform a set of algorithmic tasks, including copying, sorting, and hierarchical compositions of these operations. We demonstrate strong generalization to sequences longer than those used in training by replacing the standard positional encoding typically used in transformers with labels arbitrarily paired with items in the sequence. We search for the layer and head configuration sufficient to solve these tasks, then probe for signs of systematic processing in latent representations and attention patterns. We show that two-layer transformers learn reliable solutions to multi-level problems, develop signs of task decomposition, and encode input items in a way that encourages the exploitation of shared computation across related tasks. These results provide key insights into how attention layers support structured computation both within a task and across multiple tasks.

We propose a principled way to define Gaussian process priors on various sets of unweighted graphs: directed or undirected, with or without loops. We endow each of these sets with a geometric structure, inducing the notions of closeness and symmetries, by turning them into a vertex set of an appropriate metagraph. Building on this, we describe the class of priors that respect this structure and are analogous to the Euclidean isotropic processes, like squared exponential or Mat\'ern. We propose an efficient computational technique for the ostensibly intractable problem of evaluating these priors' kernels, making such Gaussian processes usable within the usual toolboxes and downstream applications. We go further to consider sets of equivalence classes of unweighted graphs and define the appropriate versions of priors thereon. We prove a hardness result, showing that in this case, exact kernel computation cannot be performed efficiently. However, we propose a simple Monte Carlo approximation for handling moderately sized cases. Inspired by applications in chemistry, we illustrate the proposed techniques on a real molecular property prediction task in the small data regime.

Path prediction is an essential task for many real-world Cyber-Physical Systems (CPS) applications, from autonomous driving and traffic monitoring/management to pedestrian/worker safety. These real-world CPS applications need a robust, lightweight path prediction that can provide a universal network architecture for multiple subjects (e.g., pedestrians and vehicles) from different perspectives. However, most existing algorithms are tailor-made for a unique subject with a specific camera perspective and scenario. This article presents Pishgu, a universal lightweight network architecture, as a robust and holistic solution for path prediction. Pishgu's architecture can adapt to multiple path prediction domains with different subjects (vehicles, pedestrians), perspectives (bird's-eye, high-angle), and scenes (sidewalk, highway). Our proposed architecture captures the inter-dependencies within the subjects in each frame by taking advantage of Graph Isomorphism Networks and the attention module. We separately train and evaluate the efficacy of our architecture on three different CPS domains across multiple perspectives (vehicle bird's-eye view, pedestrian bird's-eye view, and human high-angle view). Pishgu outperforms state-of-the-art solutions in the vehicle bird's-eye view domain by 42% and 61% and pedestrian high-angle view domain by 23% and 22% in terms of ADE and FDE, respectively. Additionally, we analyze the domain-specific details for various datasets to understand their effect on path prediction and model interpretation. Finally, we report the latency and throughput for all three domains on multiple embedded platforms showcasing the robustness and adaptability of Pishgu for real-world integration into CPS applications.

Pretrained Transformers achieve state-of-the-art performance in various code-processing tasks but may be too large to be deployed. As software development tools often incorporate modules for various purposes which may potentially use a single instance of the pretrained model, it appears relevant to utilize parameter-efficient fine-tuning for the pretrained models of code. In this work, we test two widely used approaches, adapters and LoRA, which were initially tested on NLP tasks, on four code-processing tasks. We find that though the efficient fine-tuning approaches may achieve comparable or higher performance than the standard, full, fine-tuning in code understanding tasks, they underperform full fine-tuning in code-generative tasks. These results underline the importance of testing efficient fine-tuning approaches on other domains than NLP and motivate future research in efficient fine-tuning for source code.

For arbitrary two probability measures on real d-space with given means and variances (covariance matrices), we provide lower bounds for their total variation distance.

Wasserstein distributionally robust optimization (DRO) has found success in operations research and machine learning applications as a powerful means to obtain solutions with favourable out-of-sample performances. Two compelling explanations for the success are the generalization bounds derived from Wasserstein DRO and the equivalency between Wasserstein DRO and the regularization scheme commonly applied in machine learning. Existing results on generalization bounds and the equivalency to regularization are largely limited to the setting where the Wasserstein ball is of a certain type and the decision criterion takes certain forms of an expected function. In this paper, we show that by focusing on Wasserstein DRO problems with affine decision rules, it is possible to obtain generalization bounds and the equivalency to regularization in a significantly broader setting where the Wasserstein ball can be of a general type and the decision criterion can be a general measure of risk, i.e., nonlinear in distributions. This allows for accommodating many important classification, regression, and risk minimization applications that have not been addressed to date using Wasserstein DRO. Our results are strong in that the generalization bounds do not suffer from the curse of dimensionality and the equivalency to regularization is exact. As a byproduct, our regularization results broaden considerably the class of Wasserstein DRO models that can be solved efficiently via regularization formulations.

Graphs are ubiquitous in nature and can therefore serve as models for many practical but also theoretical problems. For this purpose, they can be defined as many different types which suitably reflect the individual contexts of the represented problem. To address cutting-edge problems based on graph data, the research field of Graph Neural Networks (GNNs) has emerged. Despite the field's youth and the speed at which new models are developed, many recent surveys have been published to keep track of them. Nevertheless, it has not yet been gathered which GNN can process what kind of graph types. In this survey, we give a detailed overview of already existing GNNs and, unlike previous surveys, categorize them according to their ability to handle different graph types and properties. We consider GNNs operating on static and dynamic graphs of different structural constitutions, with or without node or edge attributes. Moreover, we distinguish between GNN models for discrete-time or continuous-time dynamic graphs and group the models according to their architecture. We find that there are still graph types that are not or only rarely covered by existing GNN models. We point out where models are missing and give potential reasons for their absence.

As the complexity of modern manufacturing technologies increases, traditional trial-and-error design, which requires iterative and expensive simulations, becomes unreliable and time-consuming. This difficulty is especially significant for the design of hot-stamped safety-critical components, such as ultra-high-strength-steel (UHSS) B-pillars. To reduce design costs and ensure manufacturability, scalar-based Artificial-Intelligence-empowered surrogate modelling (SAISM) has been investigated and implemented, which can allow real-time manufacturability-constrained structural design optimisation. However, SAISM suffers from low accuracy and generalisability, and usually requires a high volume of training samples. To solve this problem, an image-based Artificial-intelligence-empowered surrogate modelling (IAISM) approach is developed in this research, in combination with an auto-decoder-based blank shape generator. The IAISM, which is based on a Mask-Res-SE-U-Net architecture, is trained to predict the full thinning field of the as-formed component given an arbitrary blank shape. Excellent prediction performance of IAISM is achieved with only 256 training samples, which indicates the small-data learning nature of engineering AI tasks using structured data representations. The trained auto-decoder, trained Mask-Res-SE-U-Net, and Adam optimiser are integrated to conduct blank optimisation by modifying the latent vector. The optimiser can rapidly find blank shapes that satisfy manufacturability criteria. As a high-accuracy and generalisable surrogate modelling and optimisation tool, the proposed pipeline is promising to be integrated into a full-chain digital twin to conduct real-time, multi-objective design optimisation.

In recent times, Variational Quantum Circuits (VQC) have been widely adopted to different tasks in machine learning such as Combinatorial Optimization and Supervised Learning. With the growing interest, it is pertinent to study the boundaries of the classical simulation of VQCs to effectively benchmark the algorithms. Classically simulating VQCs can also provide the quantum algorithms with a better initialization reducing the amount of quantum resources needed to train the algorithm. This manuscript proposes an algorithm that compresses the quantum state within a circuit using a tensor ring representation which allows for the implementation of VQC based algorithms on a classical simulator at a fraction of the usual storage and computational complexity. Using the tensor ring approximation of the input quantum state, we propose a method that applies the parametrized unitary operations while retaining the low-rank structure of the tensor ring corresponding to the transformed quantum state, providing an exponential improvement of storage and computational time in the number of qubits and layers. This approximation is used to implement the tensor ring VQC for the task of supervised learning on Iris and MNIST datasets to demonstrate the comparable performance as that of the implementations from classical simulator using Matrix Product States.

Estimating the causal effects of a spatially-varying intervention on a spatially-varying outcome may be subject to non-local confounding (NLC), a phenomenon that can bias estimates when the treatments and outcomes of a given unit are dictated in part by the covariates of other nearby units. In particular, NLC is a challenge for evaluating the effects of environmental policies and climate events on health-related outcomes such as air pollution exposure. This paper first formalizes NLC using the potential outcomes framework, providing a comparison with the related phenomenon of causal interference. Then, it proposes a broadly applicable framework, termed "weather2vec", that uses the theory of balancing scores to learn representations of non-local information into a scalar or vector defined for each observational unit, which is subsequently used to adjust for confounding in conjunction with causal inference methods. The framework is evaluated in a simulation study and two case studies on air pollution where the weather is an (inherently regional) known confounder.

In recent years there has been growing attention to interpretable machine learning models which can give explanatory insights on their behavior. Thanks to their interpretability, decision trees have been intensively studied for classification tasks, and due to the remarkable advances in mixed-integer programming (MIP), various approaches have been proposed to formulate the problem of training an Optimal Classification Tree (OCT) as a MIP model. We present a novel mixed-integer quadratic formulation for the OCT problem, which exploits the generalization capabilities of Support Vector Machines for binary classification. Our model, denoted as Margin Optimal Classification Tree (MARGOT), encompasses the use of maximum margin multivariate hyperplanes nested in a binary tree structure. To enhance the interpretability of our approach, we analyse two alternative versions of MARGOT, which include feature selection constraints inducing local sparsity of the hyperplanes. First, MARGOT has been tested on non-linearly separable synthetic datasets in 2-dimensional feature space to provide a graphical representation of the maximum margin approach. Finally, the proposed models have been tested on benchmark datasets from the UCI repository. The MARGOT formulation turns out to be easier to solve than other OCT approaches, and the generated tree better generalizes on new observations. The two interpretable versions are effective in selecting the most relevant features and maintaining good prediction quality.

Identifying market abuse activity from data on investors' trading activity is very challenging both for the data volume and for the low signal to noise ratio. Here we propose two complementary unsupervised machine learning methods to support market surveillance aimed at identifying potential insider trading activities. The first one uses clustering to identify, in the vicinity of a price sensitive event such as a takeover bid, discontinuities in the trading activity of an investor with respect to his/her own past trading history and on the present trading activity of his/her peers. The second unsupervised approach aims at identifying (small) groups of investors that act coherently around price sensitive events, pointing to potential insider rings, i.e. a group of synchronised traders displaying strong directional trading in rewarding position in a period before the price sensitive event. As a case study, we apply our methods to investor resolved data of Italian stocks around takeover bids.

Recent work has shown that machine learning (ML) models can be trained to accurately forecast the dynamics of unknown chaotic dynamical systems. Short-term predictions of the state evolution and long-term predictions of the statistical patterns of the dynamics (``climate'') can be produced by employing a feedback loop, whereby the model is trained to predict forward one time step, then the model output is used as input for multiple time steps. In the absence of mitigating techniques, however, this technique can result in artificially rapid error growth. In this article, we systematically examine the technique of adding noise to the ML model input during training to promote stability and improve prediction accuracy. Furthermore, we introduce Linearized Multi-Noise Training (LMNT), a regularization technique that deterministically approximates the effect of many small, independent noise realizations added to the model input during training. Our case study uses reservoir computing, a machine-learning method using recurrent neural networks, to predict the spatiotemporal chaotic Kuramoto-Sivashinsky equation. We find that reservoir computers trained with noise or with LMNT produce climate predictions that appear to be indefinitely stable and have a climate very similar to the true system, while reservoir computers trained without regularization are unstable. Compared with other regularization techniques that yield stability in some cases, we find that both short-term and climate predictions from reservoir computers trained with noise or with LMNT are substantially more accurate. Finally, we show that the deterministic aspect of our LMNT regularization facilitates fast hyperparameter tuning when compared to training with noise.

Causal discovery for quantitative data has been extensively studied but less is known for categorical data. We propose a novel causal model for categorical data based on a new classification model, termed classification with optimal label permutation (COLP). By design, COLP is a parsimonious classifier, which gives rise to a provably identifiable causal model. A simple learning algorithm via comparing likelihood functions of causal and anti-causal models suffices to learn the causal direction. Through experiments with synthetic and real data, we demonstrate the favorable performance of the proposed COLP-based causal model compared to state-of-the-art methods. We also make available an accompanying R package COLP, which contains the proposed causal discovery algorithm and a benchmark dataset of categorical cause-effect pairs.

Code pre-trained models (CodePTMs) have recently demonstrated significant success in code intelligence. To interpret these models, some probing methods have been applied. However, these methods fail to consider the inherent characteristics of codes. In this paper, to address the problem, we propose a novel probing method CAT-probing to quantitatively interpret how CodePTMs attend code structure. We first denoise the input code sequences based on the token types pre-defined by the compilers to filter those tokens whose attention scores are too small. After that, we define a new metric CAT-score to measure the commonality between the token-level attention scores generated in CodePTMs and the pair-wise distances between corresponding AST nodes. The higher the CAT-score, the stronger the ability of CodePTMs to capture code structure. We conduct extensive experiments to integrate CAT-probing with representative CodePTMs for different programming languages. Experimental results show the effectiveness of CAT-probing in CodePTM interpretation. Our codes and data are publicly available at https://github.com/nchen909/CodeAttention.

Vision Transformers (ViTs) have achieved state-of-the-art performance on various vision tasks. However, ViTs' self-attention module is still arguably a major bottleneck, limiting their achievable hardware efficiency. Meanwhile, existing accelerators dedicated to NLP Transformers are not optimal for ViTs. This is because there is a large difference between ViTs and NLP Transformers: ViTs have a relatively fixed number of input tokens, whose attention maps can be pruned by up to 90% even with fixed sparse patterns; while NLP Transformers need to handle input sequences of varying numbers of tokens and rely on on-the-fly predictions of dynamic sparse attention patterns for each input to achieve a decent sparsity (e.g., >=50%). To this end, we propose a dedicated algorithm and accelerator co-design framework dubbed ViTCoD for accelerating ViTs. Specifically, on the algorithm level, ViTCoD prunes and polarizes the attention maps to have either denser or sparser fixed patterns for regularizing two levels of workloads without hurting the accuracy, largely reducing the attention computations while leaving room for alleviating the remaining dominant data movements; on top of that, we further integrate a lightweight and learnable auto-encoder module to enable trading the dominant high-cost data movements for lower-cost computations. On the hardware level, we develop a dedicated accelerator to simultaneously coordinate the enforced denser/sparser workloads and encoder/decoder engines for boosted hardware utilization. Extensive experiments and ablation studies validate that ViTCoD largely reduces the dominant data movement costs, achieving speedups of up to 235.3x, 142.9x, 86.0x, 10.1x, and 6.8x over general computing platforms CPUs, EdgeGPUs, GPUs, and prior-art Transformer accelerators SpAtten and Sanger under an attention sparsity of 90%, respectively.

Deep learning (DL) methods where interpretability is intrinsically considered as part of the model are required to better understand the relationship of clinical and imaging-based attributes with DL outcomes, thus facilitating their use in the reasoning behind medical decisions. Latent space representations built with variational autoencoders (VAE) do not ensure individual control of data attributes. Attribute-based methods enforcing attribute disentanglement have been proposed in the literature for classical computer vision tasks in benchmark data. In this paper, we propose a VAE approach, the Attri-VAE, that includes an attribute regularization term to associate clinical and medical imaging attributes with different regularized dimensions in the generated latent space, enabling a better-disentangled interpretation of the attributes. Furthermore, the generated attention maps explained the attribute encoding in the regularized latent space dimensions. Using the Attri-VAE approach we analyzed healthy and myocardial infarction patients with clinical, cardiac morphology, and radiomics attributes. The proposed model provided an excellent trade-off between reconstruction fidelity, disentanglement, and interpretability, outperforming state-of-the-art VAE approaches according to several quantitative metrics. The resulting latent space allowed the generation of realistic synthetic data in the trajectory between two distinct input samples or along a specific attribute dimension to better interpret changes between different cardiac conditions.

The notion of a Moreau envelope is central to the analysis of first-order optimization algorithms for machine learning. Yet, it has not been developed and extended to be applied to a deep network and, more broadly, to a machine learning system with a differentiable programming implementation. We define a compositional calculus adapted to Moreau envelopes and show how to integrate it within differentiable programming. The proposed framework casts in a mathematical optimization framework several variants of gradient back-propagation related to the idea of the propagation of virtual targets.

In supervised learning, it has been shown that label noise in the data can be interpolated without penalties on test accuracy. We show that interpolating label noise induces adversarial vulnerability, and prove the first theorem showing the relationship between label noise and adversarial risk for any data distribution. Our results are almost tight if we do not make any assumptions on the inductive bias of the learning algorithm. We then investigate how different components of this problem affect this result including properties of the distribution. We also discuss non-uniform label noise distributions; and prove a new theorem showing uniform label noise induces nearly as large an adversarial risk as the worst poisoning with the same noise rate. Then, we provide theoretical and empirical evidence that uniform label noise is more harmful than typical real-world label noise. Finally, we show how inductive biases amplify the effect of label noise and argue the need for future work in this direction.

We introduce OmniXAI (short for Omni eXplainable AI), an open-source Python library of eXplainable AI (XAI), which offers omni-way explainable AI capabilities and various interpretable machine learning techniques to address the pain points of understanding and interpreting the decisions made by machine learning (ML) in practice. OmniXAI aims to be a one-stop comprehensive library that makes explainable AI easy for data scientists, ML researchers and practitioners who need explanation for various types of data, models and explanation methods at different stages of ML process (data exploration, feature engineering, model development, evaluation, and decision-making, etc). In particular, our library includes a rich family of explanation methods integrated in a unified interface, which supports multiple data types (tabular data, images, texts, time-series), multiple types of ML models (traditional ML in Scikit-learn and deep learning models in PyTorch/TensorFlow), and a range of diverse explanation methods including "model-specific" and "model-agnostic" ones (such as feature-attribution explanation, counterfactual explanation, gradient-based explanation, etc). For practitioners, the library provides an easy-to-use unified interface to generate the explanations for their applications by only writing a few lines of codes, and also a GUI dashboard for visualization of different explanations for more insights about decisions. In this technical report, we present OmniXAI's design principles, system architectures, and major functionalities, and also demonstrate several example use cases across different types of data, tasks, and models.

In this paper, we present a robust and low complexity deep learning model for Remote Sensing Image Classification (RSIC), the task of identifying the scene of a remote sensing image. In particular, we firstly evaluate different low complexity and benchmark deep neural networks: MobileNetV1, MobileNetV2, NASNetMobile, and EfficientNetB0, which present the number of trainable parameters lower than 5 Million (M). After indicating best network architecture, we further improve the network performance by applying attention schemes to multiple feature maps extracted from middle layers of the network. To deal with the issue of increasing the model footprint as using attention schemes, we apply the quantization technique to satisfy the maximum of 20 MB memory occupation. By conducting extensive experiments on the benchmark datasets NWPU-RESISC45, we achieve a robust and low-complexity model, which is very competitive to the state-of-the-art systems and potential for real-life applications on edge devices.

Image segmentation is a fundamental task in computer vision. Data annotation for training supervised methods can be labor-intensive, motivating unsupervised methods. Some existing approaches extract deep features from pre-trained networks and build a graph to apply classical clustering methods (e.g., $k$-means and normalized-cuts) as a post-processing stage. These techniques reduce the high-dimensional information encoded in the features to pair-wise scalar affinities. In this work, we replace classical clustering algorithms with a lightweight Graph Neural Network (GNN) trained to achieve the same clustering objective function. However, in contrast to existing approaches, we feed the GNN not only the pair-wise affinities between local image features but also the raw features themselves. Maintaining this connection between the raw feature and the clustering goal allows to perform part semantic segmentation implicitly, without requiring additional post-processing steps. We demonstrate how classical clustering objectives can be formulated as self-supervised loss functions for training our image segmentation GNN. Additionally, we use the Correlation-Clustering (CC) objective to perform clustering without defining the number of clusters ($k$-less clustering). We apply the proposed method for object localization, segmentation, and semantic part segmentation tasks, surpassing state-of-the-art performance on multiple benchmarks.

This interactive paper aims to provide an intuitive understanding of the self-calibrating interface paradigm. Under this paradigm, you can choose how to use an interface which can adapt to your preferences on the fly. We introduce a PIN entering task and gradually release constraints, moving from a pre-calibrated interface to a self-calibrating interface while increasing the complexity of input modalities from buttons, to points on a map, to sketches, and finally to spoken words. This is not a traditional research paper with a hypothesis and experimental results to support claims; the research supporting this work has already been done and we refer to it extensively in the later sections. Instead, our aim is to walk you through an intriguing interaction paradigm in small logical steps with supporting illustrations, interactive demonstrations, and videos to reinforce your learning. We designed this paper for the enjoyments of curious minds of any backgrounds, it is written in plain English and no prior knowledge is necessary. All demos are available online at openvault.jgrizou.com and linked individually in the paper.

We study separations between two fundamental models (or \emph{Ans\"atze}) of antisymmetric functions, that is, functions $f$ of the form $f(x_{\sigma(1)}, \ldots, x_{\sigma(N)}) = \text{sign}(\sigma)f(x_1, \ldots, x_N)$, where $\sigma$ is any permutation. These arise in the context of quantum chemistry, and are the basic modeling tool for wavefunctions of Fermionic systems. Specifically, we consider two popular antisymmetric Ans\"atze: the Slater representation, which leverages the alternating structure of determinants, and the Jastrow ansatz, which augments Slater determinants with a product by an arbitrary symmetric function. We construct an antisymmetric function that can be more efficiently expressed in Jastrow form, yet provably cannot be approximated by Slater determinants unless there are exponentially (in $N^2$) many terms. This represents the first explicit quantitative separation between these two Ans\"atze.

The Majorana Demonstrator is a leading experiment searching for neutrinoless double-beta decay with high purity germanium detectors (HPGe). Machine learning provides a new way to maximize the amount of information provided by these detectors, but the data-driven nature makes it less interpretable compared to traditional analysis. An interpretability study reveals the machine's decision-making logic, allowing us to learn from the machine to feedback to the traditional analysis. In this work, we have presented the first machine learning analysis of the data from the Majorana Demonstrator; this is also the first interpretable machine learning analysis of any germanium detector experiment. Two gradient boosted decision tree models are trained to learn from the data, and a game-theory-based model interpretability study is conducted to understand the origin of the classification power. By learning from data, this analysis recognizes the correlations among reconstruction parameters to further enhance the background rejection performance. By learning from the machine, this analysis reveals the importance of new background categories to reciprocally benefit the standard Majorana analysis. This model is highly compatible with next-generation germanium detector experiments like LEGEND since it can be simultaneously trained on a large number of detectors.

Recently proposed Gated Linear Networks present a tractable nonlinear network architecture, and exhibit interesting capabilities such as learning with local error signals and reduced forgetting in sequential learning. In this work, we introduce a novel gating architecture, named Globally Gated Deep Linear Networks (GGDLNs) where gating units are shared among all processing units in each layer, thereby decoupling the architectures of the nonlinear but unlearned gatings and the learned linear processing motifs. We derive exact equations for the generalization properties in these networks in the finite-width thermodynamic limit, defined by $P,N\rightarrow\infty, P/N\sim O(1)$, where P and N are the training sample size and the network width respectively. We find that the statistics of the network predictor can be expressed in terms of kernels that undergo shape renormalization through a data-dependent matrix compared to the GP kernels. Our theory accurately captures the behavior of finite width GGDLNs trained with gradient descent dynamics. We show that kernel shape renormalization gives rise to rich generalization properties w.r.t. network width, depth and L2 regularization amplitude. Interestingly, networks with sufficient gating units behave similarly to standard ReLU networks. Although gatings in the model do not participate in supervised learning, we show the utility of unsupervised learning of the gating parameters. Additionally, our theory allows the evaluation of the network's ability for learning multiple tasks by incorporating task-relevant information into the gating units. In summary, our work is the first exact theoretical solution of learning in a family of nonlinear networks with finite width. The rich and diverse behavior of the GGDLNs suggests that they are helpful analytically tractable models of learning single and multiple tasks, in finite-width nonlinear deep networks.

This work proposes the continuous conditional generative adversarial network (CcGAN), the first generative model for image generation conditional on continuous, scalar conditions (termed regression labels). Existing conditional GANs (cGANs) are mainly designed for categorical conditions (eg, class labels); conditioning on regression labels is mathematically distinct and raises two fundamental problems:(P1) Since there may be very few (even zero) real images for some regression labels, minimizing existing empirical versions of cGAN losses (aka empirical cGAN losses) often fails in practice;(P2) Since regression labels are scalar and infinitely many, conventional label input methods are not applicable. The proposed CcGAN solves the above problems, respectively, by (S1) reformulating existing empirical cGAN losses to be appropriate for the continuous scenario; and (S2) proposing a naive label input (NLI) method and an improved label input (ILI) method to incorporate regression labels into the generator and the discriminator. The reformulation in (S1) leads to two novel empirical discriminator losses, termed the hard vicinal discriminator loss (HVDL) and the soft vicinal discriminator loss (SVDL) respectively, and a novel empirical generator loss. The error bounds of a discriminator trained with HVDL and SVDL are derived under mild assumptions in this work. Two new benchmark datasets (RC-49 and Cell-200) and a novel evaluation metric (Sliding Fr\'echet Inception Distance) are also proposed for this continuous scenario. Our experiments on the Circular 2-D Gaussians, RC-49, UTKFace, Cell-200, and Steering Angle datasets show that CcGAN is able to generate diverse, high-quality samples from the image distribution conditional on a given regression label. Moreover, in these experiments, CcGAN substantially outperforms cGAN both visually and quantitatively.

Classical differential private DP-SGD implements individual clipping with random subsampling, which forces a mini-batch SGD approach. We provide a general differential private algorithmic framework that goes beyond DP-SGD and allows any possible first order optimizers (e.g., classical SGD and momentum based SGD approaches) in combination with batch clipping, which clips an aggregate of computed gradients rather than summing clipped gradients (as is done in individual clipping). The framework also admits sampling techniques beyond random subsampling such as shuffling. Our DP analysis follows the $f$-DP approach and introduces a new proof technique which allows us to also analyse group privacy. In particular, for $E$ epochs work and groups of size $g$, we show a $\sqrt{g E}$ DP dependency for batch clipping with shuffling. This is much better than the previously anticipated linear dependency in $g$ and is much better than the previously expected square root dependency on the total number of rounds within $E$ epochs which is generally much more than $\sqrt{E}$.

Deep learning models for medical image segmentation can fail unexpectedly and spectacularly for pathological cases and images acquired at different centers than training images, with labeling errors that violate expert knowledge. Such errors undermine the trustworthiness of deep learning models for medical image segmentation. Mechanisms for detecting and correcting such failures are essential for safely translating this technology into clinics and are likely to be a requirement of future regulations on artificial intelligence (AI). In this work, we propose a trustworthy AI theoretical framework and a practical system that can augment any backbone AI system using a fallback method and a fail-safe mechanism based on Dempster-Shafer theory. Our approach relies on an actionable definition of trustworthy AI. Our method automatically discards the voxel-level labeling predicted by the backbone AI that violate expert knowledge and relies on a fallback for those voxels. We demonstrate the effectiveness of the proposed trustworthy AI approach on the largest reported annotated dataset of fetal MRI consisting of 540 manually annotated fetal brain 3D T2w MRIs from 13 centers. Our trustworthy AI method improves the robustness of a state-of-the-art backbone AI for fetal brain MRIs acquired across various centers and for fetuses with various brain abnormalities.

Despite the empirical successes of self-supervised learning (SSL) methods, it is unclear what characteristics of their representations lead to high downstream accuracies. In this work, we characterize properties that SSL representations should ideally satisfy. Specifically, we prove necessary and sufficient conditions such that for any task invariant to given data augmentations, desired probes (e.g., linear or MLP) trained on that representation attain perfect accuracy. These requirements lead to a unifying conceptual framework for improving existing SSL methods and deriving new ones. For contrastive learning, our framework prescribes simple but significant improvements to previous methods such as using asymmetric projection heads. For non-contrastive learning, we use our framework to derive a simple and novel objective. Our resulting SSL algorithms outperform baselines on standard benchmarks, including SwAV+multicrops on linear probing of ImageNet.

We propose a new self-supervised method for pre-training the backbone of deep perception models operating on point clouds. The core idea is to train the model on a pretext task which is the reconstruction of the surface on which the 3D points are sampled, and to use the underlying latent vectors as input to the perception head. The intuition is that if the network is able to reconstruct the scene surface, given only sparse input points, then it probably also captures some fragments of semantic information, that can be used to boost an actual perception task. This principle has a very simple formulation, which makes it both easy to implement and widely applicable to a large range of 3D sensors and deep networks performing semantic segmentation or object detection. In fact, it supports a single-stream pipeline, as opposed to most contrastive learning approaches, allowing training on limited resources. We conducted extensive experiments on various autonomous driving datasets, involving very different kinds of lidars, for both semantic segmentation and object detection. The results show the effectiveness of our method to learn useful representations without any annotation, compared to existing approaches. Code is available at https://github.com/valeoai/ALSO

We consider resource management problems in multi-user wireless networks, which can be cast as optimizing a network-wide utility function, subject to constraints on the long-term average performance of users across the network. We propose a state-augmented algorithm for solving the aforementioned radio resource management (RRM) problems, where, alongside the instantaneous network state, the RRM policy takes as input the set of dual variables corresponding to the constraints, which evolve depending on how much the constraints are violated during execution. We theoretically show that the proposed state-augmented algorithm leads to feasible and near-optimal RRM decisions. Moreover, focusing on the problem of wireless power control using graph neural network (GNN) parameterizations, we demonstrate the superiority of the proposed RRM algorithm over baseline methods across a suite of numerical experiments.

Thin-cap fibroatheroma (TCFA) and plaque rupture have been recognized as the most frequent risk factor for thrombosis and acute coronary syndrome. Intravascular optical coherence tomography (IVOCT) can identify TCFA and assess cap thickness, which provides an opportunity to assess plaque vulnerability. We developed an automated method that can detect lipidous plaque and assess fibrous cap thickness in IVOCT images. This study analyzed a total of 4,360 IVOCT image frames of 77 lesions among 41 patients. To improve segmentation performance, preprocessing included lumen segmentation, pixel-shifting, and noise filtering on the raw polar (r, theta) IVOCT images. We used the DeepLab-v3 plus deep learning model to classify lipidous plaque pixels. After lipid detection, we automatically detected the outer border of the fibrous cap using a special dynamic programming algorithm and assessed the cap thickness. Our method provided excellent discriminability of lipid plaque with a sensitivity of 85.8% and A-line Dice coefficient of 0.837. By comparing lipid angle measurements between two analysts following editing of our automated software, we found good agreement by Bland-Altman analysis (difference 6.7+/-17 degree; mean 196 degree). Our method accurately detected the fibrous cap from the detected lipid plaque. Automated analysis required a significant modification for only 5.5% frames. Furthermore, our method showed a good agreement of fibrous cap thickness between two analysts with Bland-Altman analysis (4.2+/-14.6 micron; mean 175 micron), indicating little bias between users and good reproducibility of the measurement. We developed a fully automated method for fibrous cap quantification in IVOCT images, resulting in good agreement with determinations by analysts. The method has great potential to enable highly automated, repeatable, and comprehensive evaluations of TCFAs.

To apply federated learning to drug discovery we developed a novel platform in the context of European Innovative Medicines Initiative (IMI) project MELLODDY (grant n{\deg}831472), which was comprised of 10 pharmaceutical companies, academic research labs, large industrial companies and startups. The MELLODDY platform was the first industry-scale platform to enable the creation of a global federated model for drug discovery without sharing the confidential data sets of the individual partners. The federated model was trained on the platform by aggregating the gradients of all contributing partners in a cryptographic, secure way following each training iteration. The platform was deployed on an Amazon Web Services (AWS) multi-account architecture running Kubernetes clusters in private subnets. Organisationally, the roles of the different partners were codified as different rights and permissions on the platform and administrated in a decentralized way. The MELLODDY platform generated new scientific discoveries which are described in a companion paper.

Finding extended hydrodynamics equations valid from the dense gas region to the rarefied gas region remains a great challenge. The key to success is to obtain accurate constitutive relations for stress and heat flux. Data-driven models offer a new phenomenological approach to learning constitutive relations from data. Such models enable complex constitutive relations that extend Newton's law of viscosity and Fourier's law of heat conduction by regression on higher derivatives. However, the choices of derivatives in these models are ad-hoc without a clear physical explanation. We investigated data-driven models theoretically on a linear system. We argue that these models are equivalent to non-linear length scale scaling laws of transport coefficients. The equivalence to scaling laws justified the physical plausibility and revealed the limitation of data-driven models. Our argument also points out that modeling the scaling law could avoid practical difficulties in data-driven models like derivative estimation and variable selection on noisy data. We further proposed a constitutive relation model based on scaling law and tested it on the calculation of Rayleigh scattering spectra. The result shows our data-driven model has a clear advantage over the Chapman-Enskog expansion and moment methods.

Many machine learning algorithms have been developed in recent years to enhance the performance of a model in different aspects of artificial intelligence. But the problem persists due to inadequate data and resources. Integrating knowledge in a machine learning model can help to overcome these obstacles up to a certain degree. Incorporating knowledge is a complex task though because of various forms of knowledge representation. In this paper, we will give a brief overview of these different forms of knowledge integration and their performance in certain machine learning tasks.

This paper presents a novel way to apply mathematical finance and machine learning (ML) to forecast stock options prices. Following results from the paper Quasi-Reversibility Method and Neural Network Machine Learning to Solution of Black-Scholes Equations (appeared on the AMS Contemporary Mathematics journal), we create and evaluate new empirical mathematical models for the Black-Scholes equation to analyze data for 92,846 companies. We solve the Black-Scholes (BS) equation forwards in time as an ill-posed inverse problem, using the Quasi-Reversibility Method (QRM), to predict option price for the future one day. For each company, we have 13 elements including stock and option daily prices, volatility, minimizer, etc. Because the market is so complicated that there exists no perfect model, we apply ML to train algorithms to make the best prediction. The current stage of research combines QRM with Convolutional Neural Networks (CNN), which learn information across a large number of data points simultaneously. We implement CNN to generate new results by validating and testing on sample market data. We test different ways of applying CNN and compare our CNN models with previous models to see if achieving a higher profit rate is possible.

The geographically weighted regression (GWR) is an essential tool for estimating the spatial variation of relationships between dependent and independent variables in geographical contexts. However, GWR suffers from the problem that classical linear regressions, which compose the GWR model, are more prone to be underfitting, especially for significant volume and complex nonlinear data, causing inferior comparative performance. Nevertheless, some advanced models, such as the decision tree and the support vector machine, can learn features from complex data more effectively while they cannot provide explainable quantification for the spatial variation of localized relationships. To address the above issues, we propose a geographically gradient boosting weighted regression model, GWRBoost, that applies the localized additive model and gradient boosting optimization method to alleviate underfitting problems and retains explainable quantification capability for spatially-varying relationships between geographically located variables. Furthermore, we formulate the computation method of the Akaike information score for the proposed model to conduct the comparative analysis with the classic GWR algorithm. Simulation experiments and the empirical case study are applied to prove the efficient performance and practical value of GWRBoost. The results show that our proposed model can reduce the RMSE by 18.3\% in parameter estimation accuracy and AICc by 67.3\% in the goodness of fit.

While machine learning is traditionally a resource intensive task, embedded systems, autonomous navigation, and the vision of the Internet of Things fuel the interest in resource-efficient approaches. These approaches aim for a carefully chosen trade-off between performance and resource consumption in terms of computation and energy. The development of such approaches is among the major challenges in current machine learning research and key to ensure a smooth transition of machine learning technology from a scientific environment with virtually unlimited computing resources into everyday's applications. In this article, we provide an overview of the current state of the art of machine learning techniques facilitating these real-world requirements. In particular, we focus on deep neural networks (DNNs), the predominant machine learning models of the past decade. We give a comprehensive overview of the vast literature that can be mainly split into three non-mutually exclusive categories: (i) quantized neural networks, (ii) network pruning, and (iii) structural efficiency. These techniques can be applied during training or as post-processing, and they are widely used to reduce the computational demands in terms of memory footprint, inference speed, and energy efficiency. We also briefly discuss different concepts of embedded hardware for DNNs and their compatibility with machine learning techniques as well as potential for energy and latency reduction. We substantiate our discussion with experiments on well-known benchmark datasets using compression techniques (quantization, pruning) for a set of resource-constrained embedded systems, such as CPUs, GPUs and FPGAs. The obtained results highlight the difficulty of finding good trade-offs between resource efficiency and predictive performance.

The accurate numerical solution of partial differential equations is a central task in numerical analysis allowing to model a wide range of natural phenomena by employing specialized solvers depending on the scenario of application. Here, we develop a variational approach for solving partial differential equations governing the evolution of high dimensional probability distributions. Our approach naturally works on the unbounded continuous domain and encodes the full probability density function through its variational parameters, which are adapted dynamically during the evolution to optimally reflect the dynamics of the density. For the considered benchmark cases we observe excellent agreement with numerical solutions as well as analytical solutions in regimes inaccessible to traditional computational approaches.

AI agents need to be robust to unexpected changes in their environment in order to safely operate in real-world scenarios. While some work has been done on this type of robustness in the single-agent case, in this work we introduce the idea that collaboration with other agents can help agents adapt to environment perturbations in multi-agent reinforcement learning settings. We first formalize this notion of resilience of a group of agents. We then empirically evaluate different collaboration protocols and examine their effect on resilience. We see that all of the collaboration approaches considered lead to greater resilience compared to baseline, in line with our hypothesis. We discuss future direction and the general relevance of the concept of resilience introduced in this work.

Computational imaging has been revolutionized by compressed sensing algorithms, which offer guaranteed uniqueness, convergence, and stability properties. In recent years, model-based deep learning methods that combine imaging physics with learned regularization priors have been emerging as more powerful alternatives for image recovery. The main focus of this paper is to introduce a memory efficient model-based algorithm with similar theoretical guarantees as CS methods. The proposed iterative algorithm alternates between a gradient descent involving the score function and a conjugate gradient algorithm to encourage data consistency. The score function is modeled as a monotone convolutional neural network. Our analysis shows that the monotone constraint is necessary and sufficient to enforce the uniqueness of the fixed point in arbitrary inverse problems. In addition, it also guarantees the convergence to a fixed point, which is robust to input perturbations. Current algorithms including RED and MoDL are special cases of the proposed algorithm; the proposed theoretical tools enable the optimization of the framework for the deep equilibrium setting. The proposed deep equilibrium formulation is significantly more memory efficient than unrolled methods, which allows us to apply it to 3D or 2D+time problems that current unrolled algorithms cannot handle.

ParaDime is a framework for parametric dimensionality reduction (DR). In parametric DR, neural networks are trained to embed high-dimensional data items in a low-dimensional space while minimizing an objective function. ParaDime builds on the idea that the objective functions of several modern DR techniques result from transformed inter-item relationships. It provides a common interface to specify these relations and transformations and to define how they are used within the losses that govern the training process. Through this interface, ParaDime unifies parametric versions of DR techniques such as metric MDS, t-SNE, and UMAP. Furthermore, it allows users to fully customize each aspect of the DR process. We show how this ease of customization makes ParaDime suitable for experimenting with interesting techniques, such as hybrid classification/embedding models or supervised DR, which opens up new possibilities for visualizing high-dimensional data.

Mapping between discrete and continuous distributions is a difficult task and many have had to resort to heuristical approaches. We propose a tessellation-based approach that directly learns quantization boundaries in a continuous space, complete with exact likelihood evaluations. This is done through constructing normalizing flows on convex polytopes parameterized using a simple homeomorphism with an efficient log determinant Jacobian. We explore this approach in two application settings, mapping from discrete to continuous and vice versa. Firstly, a Voronoi dequantization allows automatically learning quantization boundaries in a multidimensional space. The location of boundaries and distances between regions can encode useful structural relations between the quantized discrete values. Secondly, a Voronoi mixture model has near-constant computation cost for likelihood evaluation regardless of the number of mixture components. Empirically, we show improvements over existing methods across a range of structured data modalities.

The Internet of Medical Things (IoMT) allows the collection of physiological data using sensors, then their transmission to remote servers, permitting physicians and health professionals to analyze these data continuously and permanently. However, on the one hand, this technology faces security risks ranging from violating patient's privacy to their death due to wireless communication exposing these data to interception attacks. Moreover, these data are of particular interest to attackers due to their sensitive and private nature. On the other hand, adopting traditional security, such as cryptography on medical equipment suffering from low computing, storage and energy capacity with heterogeneous communication, represents a challenge. Moreover, these protection methods are ineffective against new attacks and zero-day attacks. Security measures must be adopted to guarantee the integrity, confidentiality and availability of data during collection, transmission, storage and processing. In this context, using Intrusion Detection Systems (IDS) based on Machine Learning (ML) can bring a complementary security solution adapted to the characteristics of IoMT systems. This paper performs a comprehensive survey on how IDS based on ML addresses security and privacy issues in IoMT systems. For this purpose, the generic three layers architecture of IoMT and the security requirement of IoMT systems are provided. Then, the various threats that can affect IoMT security and the advantages, disadvantages, methods, and datasets used in each solution based on ML are identified at the three layers composing IoMT. Finally, some challenges and limitations of applying IDS based on ML at each layer of IoMT are discussed, which can serve as a future research direction.

In order to avoid conventional controlling methods which created obstacles due to the complexity of systems and intense demand on data density, developing modern and more efficient control methods are required. In this way, reinforcement learning off-policy and model-free algorithms help to avoid working with complex models. In terms of speed and accuracy, they become prominent methods because the algorithms use their past experience to learn the optimal policies. In this study, three reinforcement learning algorithms; DDPG, TD3 and SAC have been used to train Fetch robotic manipulator for four different tasks in MuJoCo simulation environment. All of these algorithms are off-policy and able to achieve their desired target by optimizing both policy and value functions. In the current study, the efficiency and the speed of these three algorithms are analyzed in a controlled environment.

We study the problem of explainability-first clustering where explainability becomes a first-class citizen for clustering. Previous clustering approaches use decision trees for explanation, but only after the clustering is completed. In contrast, our approach is to perform clustering and decision tree training holistically where the decision tree's performance and size also influence the clustering results. We assume the attributes for clustering and explaining are distinct, although this is not necessary. We observe that our problem is a monotonic optimization where the objective function is a difference of monotonic functions. We then propose an efficient branch-and-bound algorithm for finding the best parameters that lead to a balance of cluster distortion and decision tree explainability. Our experiments show that our method can improve the explainability of any clustering that fits in our framework.

Effective inclusion of physics-based knowledge into deep neural network models of dynamical systems can greatly improve data efficiency and generalization. Such a-priori knowledge might arise from physical principles (e.g., conservation laws) or from the system's design (e.g., the Jacobian matrix of a robot), even if large portions of the system dynamics remain unknown. We develop a framework to learn dynamics models from trajectory data while incorporating a-priori system knowledge as inductive bias. More specifically, the proposed framework uses physics-based side information to inform the structure of the neural network itself, and to place constraints on the values of the outputs and the internal states of the model. It represents the system's vector field as a composition of known and unknown functions, the latter of which are parametrized by neural networks. The physics-informed constraints are enforced via the augmented Lagrangian method during the model's training. We experimentally demonstrate the benefits of the proposed approach on a variety of dynamical systems -- including a benchmark suite of robotics environments featuring large state spaces, non-linear dynamics, external forces, contact forces, and control inputs. By exploiting a-priori system knowledge during training, the proposed approach learns to predict the system dynamics two orders of magnitude more accurately than a baseline approach that does not include prior knowledge, given the same training dataset.

A machine learning model, under the influence of observed or unobserved confounders in the training data, can learn spurious correlations and fail to generalize when deployed. For image classifiers, augmenting a training dataset using counterfactual examples has been empirically shown to break spurious correlations. However, the counterfactual generation task itself becomes more difficult as the level of confounding increases. Existing methods for counterfactual generation under confounding consider a fixed set of interventions (e.g., texture, rotation) and are not flexible enough to capture diverse data-generating processes. Given a causal generative process, we formally characterize the adverse effects of confounding on any downstream tasks and show that the correlation between generative factors (attributes) can be used to quantitatively measure confounding between generative factors. To minimize such correlation, we propose a counterfactual generation method that learns to modify the value of any attribute in an image and generate new images given a set of observed attributes, even when the dataset is highly confounded. These counterfactual images are then used to regularize the downstream classifier such that the learned representations are the same across various generative factors conditioned on the class label. Our method is computationally efficient, simple to implement, and works well for any number of generative factors and confounding variables. Our experimental results on both synthetic (MNIST variants) and real-world (CelebA) datasets show the usefulness of our approach.

Multi-view subspace clustering (MSC) is a popular unsupervised method by integrating heterogeneous information to reveal the intrinsic clustering structure hidden across views. Usually, MSC methods use graphs (or affinity matrices) fusion to learn a common structure, and further apply graph-based approaches to clustering. Despite progress, most of the methods do not establish the connection between graph learning and clustering. Meanwhile, conventional graph fusion strategies assign coarse-grained weights to combine multi-graph, ignoring the importance of local structure. In this paper, we propose a fine-grained graph learning framework for multi-view subspace clustering (FGL-MSC) to address these issues. To utilize the multi-view information sufficiently, we design a specific graph learning method by introducing graph regularization and local structure fusion pattern. The main challenge is how to optimize the fine-grained fusion weights while generating the learned graph that fits the clustering task, thus making the clustering representation meaningful and competitive. Accordingly, an iterative algorithm is proposed to solve the above joint optimization problem, which obtains the learned graph, the clustering representation, and the fusion weights simultaneously. Extensive experiments on eight real-world datasets show that the proposed framework has comparable performance to the state-of-the-art methods.

Recently, improving the robustness of policies across different environments attracts increasing attention in the reinforcement learning (RL) community. Existing robust RL methods mostly aim to achieve the max-min robustness by optimizing the policy's performance in the worst-case environment. However, in practice, a user that uses an RL policy may have different preferences over its performance across environments. Clearly, the aforementioned max-min robustness is oftentimes too conservative to satisfy user preference. Therefore, in this paper, we integrate user preference into policy learning in robust RL, and propose a novel User-Oriented Robust RL (UOR-RL) framework. Specifically, we define a new User-Oriented Robustness (UOR) metric for RL, which allocates different weights to the environments according to user preference and generalizes the max-min robustness metric. To optimize the UOR metric, we develop two different UOR-RL training algorithms for the scenarios with or without a priori known environment distribution, respectively. Theoretically, we prove that our UOR-RL training algorithms converge to near-optimal policies even with inaccurate or completely no knowledge about the environment distribution. Furthermore, we carry out extensive experimental evaluations in 4 MuJoCo tasks. The experimental results demonstrate that UOR-RL is comparable to the state-of-the-art baselines under the average and worst-case performance metrics, and more importantly establishes new state-of-the-art performance under the UOR metric.

We propose a semiparametric test to evaluate (i) whether different instruments induce subpopulations of compliers with the same observable characteristics on average, and (ii) whether compliers have observable characteristics that are the same as the full population on average. The test is a flexible robustness check for the external validity of instruments. We use it to reinterpret the difference in LATE estimates that Angrist and Evans (1998) obtain when using different instrumental variables. To justify the test, we characterize the doubly robust moment for Abadie (2003)'s class of complier parameters, and we analyze a machine learning update to $\kappa$ weighting.

This paper provides theoretical insights into why and how deep learning can generalize well, despite its large capacity, complexity, possible algorithmic instability, nonrobustness, and sharp minima, responding to an open question in the literature. We also discuss approaches to provide non-vacuous generalization guarantees for deep learning. Based on theoretical observations, we propose new open problems and discuss the limitations of our results.

Two-stage robust optimization problems constitute one of the hardest optimization problem classes. One of the solution approaches to this class of problems is K-adaptability. This approach simultaneously seeks the best partitioning of the uncertainty set of scenarios into K subsets, and optimizes decisions corresponding to each of these subsets. In general case, it is solved using the K-adaptability branch-and-bound algorithm, which requires exploration of exponentially-growing solution trees. To accelerate finding high-quality solutions in such trees, we propose a machine learning-based node selection strategy. In particular, we construct a feature engineering scheme based on general two-stage robust optimization insights that allows us to train our machine learning tool on a database of resolved B&B trees, and to apply it as-is to problems of different sizes and/or types. We experimentally show that using our learned node selection strategy outperforms a vanilla, random node selection strategy when tested on problems of the same type as the training problems, also in case the K-value or the problem size differs from the training ones.

Although deep networks have shown vulnerability to evasion attacks, such attacks have usually unrealistic requirements. Recent literature discussed the possibility to remove or not some of these requirements. This paper contributes to this literature by introducing a carpet-bombing patch attack which has almost no requirement. Targeting the feature representations, this patch attack does not require knowing the network task. This attack decreases accuracy on Imagenet, mAP on Pascal Voc, and IoU on Cityscapes without being aware that the underlying tasks involved classification, detection or semantic segmentation, respectively. Beyond the potential safety issues raised by this attack, the impact of the carpet-bombing attack highlights some interesting property of deep network layer dynamic.

How can we perform efficient inference and learning in directed probabilistic models, in the presence of continuous latent variables with intractable posterior distributions, and large datasets? We introduce a stochastic variational inference and learning algorithm that scales to large datasets and, under some mild differentiability conditions, even works in the intractable case. Our contributions are two-fold. First, we show that a reparameterization of the variational lower bound yields a lower bound estimator that can be straightforwardly optimized using standard stochastic gradient methods. Second, we show that for i.i.d. datasets with continuous latent variables per datapoint, posterior inference can be made especially efficient by fitting an approximate inference model (also called a recognition model) to the intractable posterior using the proposed lower bound estimator. Theoretical advantages are reflected in experimental results.

Reasoning is central to human intelligence. However, fallacious arguments are common, and some exacerbate problems such as spreading misinformation about climate change. In this paper, we propose the task of logical fallacy detection, and provide a new dataset (Logic) of logical fallacies generally found in text, together with an additional challenge set for detecting logical fallacies in climate change claims (LogicClimate). Detecting logical fallacies is a hard problem as the model must understand the underlying logical structure of the argument. We find that existing pretrained large language models perform poorly on this task. In contrast, we show that a simple structure-aware classifier outperforms the best language model by 5.46% on Logic and 4.51% on LogicClimate. We encourage future work to explore this task as (a) it can serve as a new reasoning challenge for language models, and (b) it can have potential applications in tackling the spread of misinformation. Our dataset and code are available at https://github.com/causalNLP/logical-fallacy

This paper provides estimation and inference methods for an identified set's boundary (i.e., support function) where the selection among a very large number of covariates is based on modern regularized tools. I characterize the boundary using a semiparametric moment equation. Combining Neyman-orthogonality and sample splitting ideas, I construct a root-N consistent, uniformly asymptotically Gaussian estimator of the boundary and propose a multiplier bootstrap procedure to conduct inference. I apply this result to the partially linear model, the partially linear IV model and the average partial derivative with an interval-valued outcome.

Class-incremental learning (CIL) learns a classification model with training data of different classes arising progressively. Existing CIL either suffers from serious accuracy loss due to catastrophic forgetting, or invades data privacy by revisiting used exemplars. Inspired by linear learning formulations, we propose an analytic class-incremental learning (ACIL) with absolute memorization of past knowledge while avoiding breaching of data privacy (i.e., without storing historical data). The absolute memorization is demonstrated in the sense that class-incremental learning using ACIL given present data would give identical results to that from its joint-learning counterpart which consumes both present and historical samples. This equality is theoretically validated. Data privacy is ensured since no historical data are involved during the learning process. Empirical validations demonstrate ACIL's competitive accuracy performance with near-identical results for various incremental task settings (e.g., 5-50 phases). This also allows ACIL to outperform the state-of-the-art methods for large-phase scenarios (e.g., 25 and 50 phases).

Remaining Useful Life (RUL) estimation plays a critical role in Prognostics and Health Management (PHM). Traditional machine health maintenance systems are often costly, requiring sufficient prior expertise, and are difficult to fit into highly complex and changing industrial scenarios. With the widespread deployment of sensors on industrial equipment, building the Industrial Internet of Things (IIoT) to interconnect these devices has become an inexorable trend in the development of the digital factory. Using the device's real-time operational data collected by IIoT to get the estimated RUL through the RUL prediction algorithm, the PHM system can develop proactive maintenance measures for the device, thus, reducing maintenance costs and decreasing failure times during operation. This paper carries out research into the remaining useful life prediction model for multi-sensor devices in the IIoT scenario. We investigated the mainstream RUL prediction models and summarized the basic steps of RUL prediction modeling in this scenario. On this basis, a data-driven approach for RUL estimation is proposed in this paper. It employs a Multi-Head Attention Mechanism to fuse the multi-dimensional time-series data output from multiple sensors, in which the attention on features is used to capture the interactions between features and attention on sequences is used to learn the weights of time steps. Then, the Long Short-Term Memory Network is applied to learn the features of time series. We evaluate the proposed model on two benchmark datasets (C-MAPSS and PHM08), and the results demonstrate that it outperforms the state-of-art models. Moreover, through the interpretability of the multi-head attention mechanism, the proposed model can provide a preliminary explanation of engine degradation. Therefore, this approach is promising for predictive maintenance in IIoT scenarios.

Transportation mode classification, the process of predicting the class labels of moving objects transportation modes, has been widely applied to a variety of real world applications, such as traffic management, urban computing, and behavior study. However, existing studies of transportation mode classification typically extract the explicit features of trajectory data but fail to capture the implicit features that affect the classification performance. In addition, most of the existing studies also prefer to apply RNN-based models to embed trajectories, which is only suitable for classifying small-scale data. To tackle the above challenges, we propose an effective and scalable framework for transportation mode classification over GPS trajectories, abbreviated Estimator. Estimator is established on a developed CNN-TCN architecture, which is capable of leveraging the spatial and temporal hidden features of trajectories to achieve high effectiveness and efficiency. Estimator partitions the entire traffic space into disjointed spatial regions according to traffic conditions, which enhances the scalability significantly and thus enables parallel transportation classification. Extensive experiments using eight public real-life datasets offer evidence that Estimator i) achieves superior model effectiveness (i.e., 99% Accuracy and 0.98 F1-score), which outperforms state-of-the-arts substantially; ii) exhibits prominent model efficiency, and obtains 7-40x speedups up over state-of-the-arts learning-based methods; and iii) shows high model scalability and robustness that enables large-scale classification analytics.

Causal inference is the process of using assumptions, study designs, and estimation strategies to draw conclusions about the causal relationships between variables based on data. This allows researchers to better understand the underlying mechanisms at work in complex systems and make more informed decisions. In many settings, we may not fully observe all the confounders that affect both the treatment and outcome variables, complicating the estimation of causal effects. To address this problem, a growing literature in both causal inference and machine learning proposes to use Instrumental Variables (IV). This paper serves as the first effort to systematically and comprehensively introduce and discuss the IV methods and their applications in both causal inference and machine learning. First, we provide the formal definition of IVs and discuss the identification problem of IV regression methods under different assumptions. Second, we categorize the existing work on IV methods into three streams according to the focus on the proposed methods, including two-stage least squares with IVs, control function with IVs, and evaluation of IVs. For each stream, we present both the classical causal inference methods, and recent developments in the machine learning literature. Then, we introduce a variety of applications of IV methods in real-world scenarios and provide a summary of the available datasets and algorithms. Finally, we summarize the literature, discuss the open problems and suggest promising future research directions for IV methods and their applications. We also develop a toolkit of IVs methods reviewed in this survey at https://github.com/causal-machine-learning-lab/mliv.

Traffic forecasting is an important application of spatiotemporal series prediction. Among different methods, graph neural networks have achieved so far the most promising results, learning relations between graph nodes then becomes a crucial task. However, improvement space is very limited when these relations are learned in a node-to-node manner. The challenge stems from (1) obscure temporal dependencies between different stations, (2) difficulties in defining variables beyond the node level, and (3) no ready-made method to validate the learned relations. To confront these challenges, we define legitimate traffic causal variables to discover the causal relation inside the traffic network, which is carefully checked with statistic tools and case analysis. We then present a novel model named Graph Spatial-Temporal Network Based on Causal Insight (GT-CausIn), where prior learned causal information is integrated with graph diffusion layers and temporal convolutional network (TCN) layers. Experiments are carried out on two real-world traffic datasets: PEMS-BAY and METR-LA, which show that GT-CausIn significantly outperforms the state-of-the-art models on mid-term and long-term prediction.

Numerous models have tried to effectively embed knowledge graphs in low dimensions. Among the state-of-the-art methods, Graph Neural Network (GNN) models provide structure-aware representations of knowledge graphs. However, they often utilize the information of relations and their interactions with entities inefficiently. Moreover, most state-of-the-art knowledge graph embedding models suffer from scalability issues because of assigning high-dimensional embeddings to entities and relations. To address the above limitations, we propose a scalable general knowledge graph encoder that adaptively involves a powerful tensor decomposition method in the aggregation function of RGCN, a well-known relational GNN model. Specifically, the parameters of a low-rank core projection tensor, used to transform neighborhood entities in the encoder, are shared across relations to benefit from multi-task learning and incorporate relations information effectively. Besides, we propose a low-rank estimation of the core tensor using CP decomposition to compress the model, which is also applicable, as a regularization method, to other similar linear models. We evaluated our model on knowledge graph completion as a common downstream task. We train our model for using a new loss function based on contrastive learning, which relieves the training limitation of the 1-N method on huge graphs. We improved RGCN performance on FB15-237 by 0.42% with considerably lower dimensionality of embeddings.

Theory of Mind is an essential ability of humans to infer the mental states of others. Here we provide a coherent summary of the potential, current progress, and problems of deep learning approaches to Theory of Mind. We highlight that many current findings can be explained through shortcuts. These shortcuts arise because the tasks used to investigate Theory of Mind in deep learning systems have been too narrow. Thus, we encourage researchers to investigate Theory of Mind in complex open-ended environments. Furthermore, to inspire future deep learning systems we provide a concise overview of prior work done in humans. We further argue that when studying Theory of Mind with deep learning, the research's main focus and contribution ought to be opening up the network's representations. We recommend researchers use tools from the field of interpretability of AI to study the relationship between different network components and aspects of Theory of Mind.

In this work we demonstrate a novel separation between symmetric neural network architectures. Specifically, we consider the Relational Network~\parencite{santoro2017simple} architecture as a natural generalization of the DeepSets~\parencite{zaheer2017deep} architecture, and study their representational gap. Under the restriction to analytic activation functions, we construct a symmetric function acting on sets of size $N$ with elements in dimension $D$, which can be efficiently approximated by the former architecture, but provably requires width exponential in $N$ and $D$ for the latter.

Weighted finite automata (WFAs) have been widely applied in many fields. One of the classic problems for WFAs is probability distribution estimation over sequences of discrete symbols. Although WFAs have been extended to deal with continuous input data, namely continuous WFAs (CWFAs), it is still unclear how to approximate density functions over sequences of continuous random variables using WFA-based models, due to the limitation on the expressiveness of the model as well as the tractability of approximating density functions via CWFAs. In this paper, we propose a nonlinear extension to the CWFA model to first improve its expressiveness, we refer to it as the nonlinear continuous WFAs (NCWFAs). Then we leverage the so-called RNADE method, which is a well-known density estimator based on neural networks, and propose the RNADE-NCWFA model. The RNADE-NCWFA model computes a density function by design. We show that this model is strictly more expressive than the Gaussian HMM model, which CWFA cannot approximate. Empirically, we conduct a synthetic experiment using Gaussian HMM generated data. We focus on evaluating the model's ability to estimate densities for sequences of varying lengths (longer length than the training data). We observe that our model performs the best among the compared baseline methods.

Federated learning allows collaborative workers to solve a machine learning problem while preserving data privacy. Recent studies have tackled various challenges in federated learning, but the joint optimization of communication overhead, learning reliability, and deployment efficiency is still an open problem. To this end, we propose a new scheme named federated learning via plurality vote (FedVote). In each communication round of FedVote, workers transmit binary or ternary weights to the server with low communication overhead. The model parameters are aggregated via weighted voting to enhance the resilience against Byzantine attacks. When deployed for inference, the model with binary or ternary weights is resource-friendly to edge devices. We show that our proposed method can reduce quantization error and converges faster compared with the methods directly quantizing the model updates.

WiFi sensing technology has shown superiority in smart homes among various sensors for its cost-effective and privacy-preserving merits. It is empowered by Channel State Information (CSI) extracted from WiFi signals and advanced machine learning models to analyze motion patterns in CSI. Many learning-based models have been proposed for kinds of applications, but they severely suffer from environmental dependency. Though domain adaptation methods have been proposed to tackle this issue, it is not practical to collect high-quality, well-segmented and balanced CSI samples in a new environment for adaptation algorithms, but randomly-captured CSI samples can be easily collected. {\color{black}In this paper, we firstly explore how to learn a robust model from these low-quality CSI samples, and propose AutoFi, an annotation-efficient WiFi sensing model based on a novel geometric self-supervised learning algorithm.} The AutoFi fully utilizes unlabeled low-quality CSI samples that are captured randomly, and then transfers the knowledge to specific tasks defined by users, which is the first work to achieve cross-task transfer in WiFi sensing. The AutoFi is implemented on a pair of Atheros WiFi APs for evaluation. The AutoFi transfers knowledge from randomly collected CSI samples into human gait recognition and achieves state-of-the-art performance. Furthermore, we simulate cross-task transfer using public datasets to further demonstrate its capacity for cross-task learning. For the UT-HAR and Widar datasets, the AutoFi achieves satisfactory results on activity recognition and gesture recognition without any prior training. We believe that the AutoFi takes a huge step toward automatic WiFi sensing without any developer engagement.

The spectra of random feature matrices provide essential information on the conditioning of the linear system used in random feature regression problems and are thus connected to the consistency and generalization of random feature models. Random feature matrices are asymmetric rectangular nonlinear matrices depending on two input variables, the data and the weights, which can make their characterization challenging. We consider two settings for the two input variables, either both are random variables or one is a random variable and the other is well-separated, i.e. there is a minimum distance between points. With conditions on the dimension, the complexity ratio, and the sampling variance, we show that the singular values of these matrices concentrate near their full expectation and near one with high-probability. In particular, since the dimension depends only on the logarithm of the number of random weights or the number of data points, our complexity bounds can be achieved even in moderate dimensions for many practical setting. The theoretical results are verified with numerical experiments.

Bayesian optimization (BO) is one of the most effective methods for closed-loop experimental design and black-box optimization. However, a key limitation of BO is that it is an inherently sequential algorithm (one experiment is proposed per round) and thus cannot directly exploit high-throughput (parallel) experiments. Diverse modifications to the BO framework have been proposed in the literature to enable exploitation of parallel experiments but such approaches are limited in the degree of parallelization that they can achieve and can lead to redundant experiments (thus wasting resources and potentially compromising performance). In this work, we present new parallel BO paradigms that exploit the structure of the system to partition the design space. Specifically, we propose an approach that partitions the design space by following the level sets of the performance function and an approach that exploits partially-separable structures of the performance function found. We conduct extensive numerical experiments using a reactor case study to benchmark the effectiveness of these approaches against a variety of state-of-the-art parallel algorithms reported in the literature. Our computational results show that our approaches significantly reduce the required search time and increase the probability of finding a global (rather than local) solution.

We investigate the parameterization of deep neural networks that by design satisfy the continuity equation, a fundamental conservation law. This is enabled by the observation that any solution of the continuity equation can be represented as a divergence-free vector field. We hence propose building divergence-free neural networks through the concept of differential forms, and with the aid of automatic differentiation, realize two practical constructions. As a result, we can parameterize pairs of densities and vector fields that always exactly satisfy the continuity equation, foregoing the need for extra penalty methods or expensive numerical simulation. Furthermore, we prove these models are universal and so can be used to represent any divergence-free vector field. Finally, we experimentally validate our approaches by computing neural network-based solutions to fluid equations, solving for the Hodge decomposition, and learning dynamical optimal transport maps.

We revisit a simple Learning-from-Scratch baseline for visuo-motor control that uses data augmentation and a shallow ConvNet. We find that this baseline has competitive performance with recent methods that leverage frozen visual representations trained on large-scale vision datasets.

Malaria is a potentially fatal plasmodium parasite injected by female anopheles mosquitoes that infect red blood cells and millions worldwide yearly. However, specialists' manual screening in clinical practice is laborious and prone to error. Therefore, a novel Deep Boosted and Ensemble Learning (DBEL) framework, comprising the stacking of new Boosted-BR-STM convolutional neural networks (CNN) and the ensemble ML classifiers, is developed to screen malaria parasite images. The proposed Boosted-BR-STM is based on a new dilated-convolutional block-based split transform merge (STM) and feature-map Squeezing-Boosting (SB) ideas. Moreover, the new STM block uses regional and boundary operations to learn the malaria parasite's homogeneity, heterogeneity, and boundary with patterns. Furthermore, the diverse boosted channels are attained by employing Transfer Learning-based new feature-map SB in STM blocks at the abstract, medium, and conclusion levels to learn minute intensity and texture variation of the parasitic pattern. The proposed DBEL framework implicates the stacking of prominent and diverse boosted channels and provides the generated discriminative features of the developed Boosted-BR-STM to the ensemble of ML classifiers. The proposed framework improves the discrimination ability and generalization of ensemble learning. Moreover, the deep feature spaces of the developed Boosted-BR-STM and customized CNNs are fed into ML classifiers for comparative analysis. The proposed DBEL framework outperforms the existing techniques on the NIH malaria dataset that are enhanced using discrete wavelet transform to enrich feature space. The proposed DBEL framework achieved Accuracy (98.50%), Sensitivity (0.9920), F-score (0.9850), and AUC (0.997), which suggest it to be utilized for malaria parasite screening.

Understanding customer feedback is becoming a necessity for companies to identify problems and improve their products and services. Text classification and sentiment analysis can play a major role in analyzing this data by using a variety of machine and deep learning approaches. In this work, different transformer-based models are utilized to explore how efficient these models are when working with a German customer feedback dataset. In addition, these pre-trained models are further analyzed to determine if adapting them to a specific domain using unlabeled data can yield better results than off-the-shelf pre-trained models. To evaluate the models, two downstream tasks from the GermEval 2017 are considered. The experimental results show that transformer-based models can reach significant improvements compared to a fastText baseline and outperform the published scores and previous models. For the subtask Relevance Classification, the best models achieve a micro-averaged $F1$-Score of 96.1 % on the first test set and 95.9 % on the second one, and a score of 85.1 % and 85.3 % for the subtask Polarity Classification.

We introduce the XPER (eXplainable PERformance) methodology to measure the specific contribution of the input features to the predictive or economic performance of a model. Our methodology offers several advantages. First, it is both model-agnostic and performance metric-agnostic. Second, XPER is theoretically founded as it is based on Shapley values. Third, the interpretation of the benchmark, which is inherent in any Shapley value decomposition, is meaningful in our context. Fourth, XPER is not plagued by model specification error, as it does not require re-estimating the model. Fifth, it can be implemented either at the model level or at the individual level. In an application based on auto loans, we find that performance can be explained by a surprisingly small number of features. XPER decompositions are rather stable across metrics, yet some feature contributions switch sign across metrics. Our analysis also shows that explaining model forecasts and model performance are two distinct tasks.

In this work, we propose a family of novel quantum kernels, namely the Hierarchical Aligned Quantum Jensen-Shannon Kernels (HAQJSK), for un-attributed graphs. Different from most existing classical graph kernels, the proposed HAQJSK kernels can incorporate hierarchical aligned structure information between graphs and transform graphs of random sizes into fixed-sized aligned graph structures, i.e., the Hierarchical Transitive Aligned Adjacency Matrix of vertices and the Hierarchical Transitive Aligned Density Matrix of the Continuous-Time Quantum Walk (CTQW). For a pair of graphs to hand, the resulting HAQJSK kernels are defined by measuring the Quantum Jensen-Shannon Divergence (QJSD) between their transitive aligned graph structures. We show that the proposed HAQJSK kernels not only reflect richer intrinsic global graph characteristics in terms of the CTQW, but also address the drawback of neglecting structural correspondence information arising in most existing R-convolution kernels. Furthermore, unlike the previous Quantum Jensen-Shannon Kernels associated with the QJSD and the CTQW, the proposed HAQJSK kernels can simultaneously guarantee the properties of permutation invariant and positive definiteness, explaining the theoretical advantages of the HAQJSK kernels. Experiments indicate the effectiveness of the proposed kernels.

Model-based reinforcement learning (RL) is a sample-efficient way of learning complex behaviors by leveraging a learned single-step dynamics model to plan actions in imagination. However, planning every action for long-horizon tasks is not practical, akin to a human planning out every muscle movement. Instead, humans efficiently plan with high-level skills to solve complex tasks. From this intuition, we propose a Skill-based Model-based RL framework (SkiMo) that enables planning in the skill space using a skill dynamics model, which directly predicts the skill outcomes, rather than predicting all small details in the intermediate states, step by step. For accurate and efficient long-term planning, we jointly learn the skill dynamics model and a skill repertoire from prior experience. We then harness the learned skill dynamics model to accurately simulate and plan over long horizons in the skill space, which enables efficient downstream learning of long-horizon, sparse reward tasks. Experimental results in navigation and manipulation domains show that SkiMo extends the temporal horizon of model-based approaches and improves the sample efficiency for both model-based RL and skill-based RL. Code and videos are available at https://clvrai.com/skimo

Machine Learning as a service (MLaaS) permits resource-limited clients to access powerful data analytics services ubiquitously. Despite its merits, MLaaS poses significant concerns regarding the integrity of delegated computation and the privacy of the server's model parameters. To address this issue, Zhang et al. (CCS'20) initiated the study of zero-knowledge Machine Learning (zkML). Few zkML schemes have been proposed afterward; however, they focus on sole ML classification algorithms that may not offer satisfactory accuracy or require large-scale training data and model parameters, which may not be desirable for some applications. We propose ezDPS, a new efficient and zero-knowledge ML inference scheme. Unlike prior works, ezDPS is a zkML pipeline in which the data is processed in multiple stages for high accuracy. Each stage of ezDPS is harnessed with an established ML algorithm that is shown to be effective in various applications, including Discrete Wavelet Transformation, Principal Components Analysis, and Support Vector Machine. We design new gadgets to prove ML operations effectively. We fully implemented ezDPS and assessed its performance on real datasets. Experimental results showed that ezDPS achieves one-to-three orders of magnitude more efficient than the generic circuit-based approach in all metrics while maintaining more desirable accuracy than single ML classification approaches.

Although considerable progress has been obtained in neural network quantization for efficient inference, existing methods are not scalable to heterogeneous devices as one dedicated model needs to be trained, transmitted, and stored for one specific hardware setting, incurring considerable costs in model training and maintenance. In this paper, we study a new vertical-layered representation of neural network weights for encapsulating all quantized models into a single one. With this representation, we can theoretically achieve any precision network for on-demand service while only needing to train and maintain one model. To this end, we propose a simple once quantization-aware training (QAT) scheme for obtaining high-performance vertical-layered models. Our design incorporates a cascade downsampling mechanism which allows us to obtain multiple quantized networks from one full precision source model by progressively mapping the higher precision weights to their adjacent lower precision counterparts. Then, with networks of different bit-widths from one source model, multi-objective optimization is employed to train the shared source model weights such that they can be updated simultaneously, considering the performance of all networks. By doing this, the shared weights will be optimized to balance the performance of different quantized models, thus making the weights transferable among different bit widths. Experiments show that the proposed vertical-layered representation and developed once QAT scheme are effective in embodying multiple quantized networks into a single one and allow one-time training, and it delivers comparable performance as that of quantized models tailored to any specific bit-width. Code will be available.

Inserting an SVD meta-layer into neural networks is prone to make the covariance ill-conditioned, which could harm the model in the training stability and generalization abilities. In this paper, we systematically study how to improve the covariance conditioning by enforcing orthogonality to the Pre-SVD layer. Existing orthogonal treatments on the weights are first investigated. However, these techniques can improve the conditioning but would hurt the performance. To avoid such a side effect, we propose the Nearest Orthogonal Gradient (NOG) and Optimal Learning Rate (OLR). The effectiveness of our methods is validated in two applications: decorrelated Batch Normalization (BN) and Global Covariance Pooling (GCP). Extensive experiments on visual recognition demonstrate that our methods can simultaneously improve covariance conditioning and generalization. The combinations with orthogonal weight can further boost the performance. Moreover, we show that our orthogonality techniques can benefit generative models for better latent disentanglement through a series of experiments on various benchmarks. Code is available at: \href{https://github.com/KingJamesSong/OrthoImproveCond}{https://github.com/KingJamesSong/OrthoImproveCond}.

Traffic signal control is an important problem in urban mobility with a significant potential of economic and environmental impact. While there is a growing interest in Reinforcement Learning (RL) for traffic signal control, the work so far has focussed on learning through simulations which could lead to inaccuracies due to simplifying assumptions. Instead, real experience data on traffic is available and could be exploited at minimal costs. Recent progress in offline or batch RL has enabled just that. Model-based offline RL methods, in particular, have been shown to generalize from the experience data much better than others. We build a model-based learning framework which infers a Markov Decision Process (MDP) from a dataset collected using a cyclic traffic signal control policy that is both commonplace and easy to gather. The MDP is built with pessimistic costs to manage out-of-distribution scenarios using an adaptive shaping of rewards which is shown to provide better regularization compared to the prior related work in addition to being PAC-optimal. Our model is evaluated on a complex signalized roundabout showing that it is possible to build highly performant traffic control policies in a data efficient manner.

Computational models are quantitative representations of systems. By analyzing and comparing the outputs of such models, it is possible to gain a better understanding of the system itself. Though as the complexity of model outputs increases, it becomes increasingly difficult to compare simulations to each other. While it is straightforward to only compare a few specific model outputs across multiple simulations, additional useful information can come from comparing model simulations as a whole. However, it is difficult to holistically compare model simulations in an unbiased manner. To address these limitations, we use representation learning to transform model simulations into low-dimensional points, with the neural networks capturing the relationships between the model outputs without the need to manually specify which outputs to focus on. The distance in low-dimensional space acts as a comparison metric, reducing the difference between simulations to a single value. We provide an approach to training neural networks on model simulations and display how the trained networks can then be used to provide a holistic comparison of model outputs. This approach can be applied to a wide range of model types, providing a quantitative method of analyzing the complex outputs of computational models.

Embedding tables are usually huge in click-through rate (CTR) prediction models. To train and deploy the CTR models efficiently and economically, it is necessary to compress their embedding tables at the training stage. To this end, we formulate a novel quantization training paradigm to compress the embeddings from the training stage, termed low-precision training (LPT). Also, we provide theoretical analysis on its convergence. The results show that stochastic weight quantization has a faster convergence rate and a smaller convergence error than deterministic weight quantization in LPT. Further, to reduce the accuracy degradation, we propose adaptive low-precision training (ALPT) that learns the step size (i.e., the quantization resolution) through gradient descent. Experiments on two real-world datasets confirm our analysis and show that ALPT can significantly improve the prediction accuracy, especially at extremely low bit widths. For the first time in CTR models, we successfully train 8-bit embeddings without sacrificing prediction accuracy. The code of ALPT is publicly available.

We develop an optimization algorithm suitable for Bayesian learning in complex models. Our approach relies on natural gradient updates within a general black-box framework for efficient training with limited model-specific derivations. It applies within the class of exponential-family variational posterior distributions, for which we extensively discuss the Gaussian case for which the updates have a rather simple form. Our Quasi Black-box Variational Inference (QBVI) framework is readily applicable to a wide class of Bayesian inference problems and is of simple implementation as the updates of the variational posterior do not involve gradients with respect to the model parameters, nor the prescription of the Fisher information matrix. We develop QBVI under different hypotheses for the posterior covariance matrix, discuss details about its robust and feasible implementation, and provide a number of real-world applications to demonstrate its effectiveness.

In recent years, deep learning (DL) models have demonstrated remarkable achievements on non-trivial tasks such as speech recognition and natural language understanding. One of the significant contributors to its success is the proliferation of end devices that acted as a catalyst to provide data for data-hungry DL models. However, computing DL training and inference is the main challenge. Usually, central cloud servers are used for the computation, but it opens up other significant challenges, such as high latency, increased communication costs, and privacy concerns. To mitigate these drawbacks, considerable efforts have been made to push the processing of DL models to edge servers. Moreover, the confluence point of DL and edge has given rise to edge intelligence (EI). This survey paper focuses primarily on the fifth level of EI, called all in-edge level, where DL training and inference (deployment) are performed solely by edge servers. All in-edge is suitable when the end devices have low computing resources, e.g., Internet-of-Things, and other requirements such as latency and communication cost are important in mission-critical applications, e.g., health care. Firstly, this paper presents all in-edge computing architectures, including centralized, decentralized, and distributed. Secondly, this paper presents enabling technologies, such as model parallelism and split learning, which facilitate DL training and deployment at edge servers. Thirdly, model adaptation techniques based on model compression and conditional computation are described because the standard cloud-based DL deployment cannot be directly applied to all in-edge due to its limited computational resources. Fourthly, this paper discusses eleven key performance metrics to evaluate the performance of DL at all in-edge efficiently. Finally, several open research challenges in the area of all in-edge are presented.

Few-shot node classification is tasked to provide accurate predictions for nodes from novel classes with only few representative labeled nodes. This problem has drawn tremendous attention for its projection to prevailing real-world applications, such as product categorization for newly added commodity categories on an E-commerce platform with scarce records or diagnoses for rare diseases on a patient similarity graph. To tackle such challenging label scarcity issues in the non-Euclidean graph domain, meta-learning has become a successful and predominant paradigm. More recently, inspired by the development of graph self-supervised learning, transferring pretrained node embeddings for few-shot node classification could be a promising alternative to meta-learning but remains unexposed. In this work, we empirically demonstrate the potential of an alternative framework, \textit{Transductive Linear Probing}, that transfers pretrained node embeddings, which are learned from graph contrastive learning methods. We further extend the setting of few-shot node classification from standard fully supervised to a more realistic self-supervised setting, where meta-learning methods cannot be easily deployed due to the shortage of supervision from training classes. Surprisingly, even without any ground-truth labels, transductive linear probing with self-supervised graph contrastive pretraining can outperform the state-of-the-art fully supervised meta-learning based methods under the same protocol. We hope this work can shed new light on few-shot node classification problems and foster future research on learning from scarcely labeled instances on graphs.

Quantization has become a predominant approach for model compression, enabling deployment of large models trained on GPUs onto smaller form-factor devices for inference. Quantization-aware training (QAT) optimizes model parameters with respect to the end task while simulating quantization error, leading to better performance than post-training quantization. Approximation of gradients through the non-differentiable quantization operator is typically achieved using the straight-through estimator (STE) or additive noise. However, STE-based methods suffer from instability due to biased gradients, whereas existing noise-based methods cannot reduce the resulting variance. In this work, we incorporate exponentially decaying quantization-error-aware noise together with a learnable scale of task loss gradient to approximate the effect of a quantization operator. We show this method combines gradient scale and quantization noise in a better optimized way, providing finer-grained estimation of gradients at each weight and activation layer's quantizer bin size. Our controlled noise also contains an implicit curvature term that could encourage flatter minima, which we show is indeed the case in our experiments. Experiments training ResNet architectures on the CIFAR-10, CIFAR-100 and ImageNet benchmarks show that our method obtains state-of-the-art top-1 classification accuracy for uniform (non mixed-precision) quantization, out-performing previous methods by 0.5-1.2% absolute.

Particle dynamics and multi-agent systems provide accurate dynamical models for studying and forecasting the behavior of complex interacting systems. They often take the form of a high-dimensional system of differential equations parameterized by an interaction kernel that models the underlying attractive or repulsive forces between agents. We consider the problem of constructing a data-based approximation of the interacting forces directly from noisy observations of the paths of the agents in time. The learned interaction kernels are then used to predict the agents behavior over a longer time interval. The approximation developed in this work uses a randomized feature algorithm and a sparse randomized feature approach. Sparsity-promoting regression provides a mechanism for pruning the randomly generated features which was observed to be beneficial when one has limited data, in particular, leading to less overfitting than other approaches. In addition, imposing sparsity reduces the kernel evaluation cost which significantly lowers the simulation cost for forecasting the multi-agent systems. Our method is applied to various examples, including first-order systems with homogeneous and heterogeneous interactions, second order homogeneous systems, and a new sheep swarming system.

Neural networks are becoming increasingly popular in applications, but our mathematical understanding of their potential and limitations is still limited. In this paper, we further this understanding by developing statistical guarantees for sparse deep learning. In contrast to previous work, we consider different types of sparsity, such as few active connections, few active nodes, and other norm-based types of sparsity. Moreover, our theories cover important aspects that previous theories have neglected, such as multiple outputs, regularization, and l2-loss. The guarantees have a mild dependence on network widths and depths, which means that they support the application of sparse but wide and deep networks from a statistical perspective. Some of the concepts and tools that we use in our derivations are uncommon in deep learning and, hence, might be of additional interest.

The success of graph neural networks on graph-based web mining highly relies on abundant human-annotated data, which is laborious to obtain in practice. When only few labeled nodes are available, how to improve their robustness is a key to achieve replicable and sustainable graph semi-supervised learning. Though self-training has been shown to be powerful for semi-supervised learning, its application on graph-structured data may fail because (1) larger receptive fields are not leveraged to capture long-range node interactions, which exacerbates the difficulty of propagating feature-label patterns from labeled nodes to unlabeled nodes; and (2) limited labeled data makes it challenging to learn well-separated decision boundaries for different node classes without explicitly capturing the underlying semantic structure. To address the challenges of capturing informative structural and semantic knowledge, we propose a new graph data augmentation framework, AGST (Augmented Graph Self-Training), which is built with two new (i.e., structural and semantic) augmentation modules on top of a decoupled GST backbone. In this work, we investigate whether this novel framework can learn a robust graph predictive model under the low-data context. We conduct comprehensive evaluations on semi-supervised node classification under different scenarios of limited labeled-node data. The experimental results demonstrate the unique contributions of the novel data augmentation framework for node classification with few labeled data.

Deep neural networks (DNNs) recently emerged as a promising tool for analyzing and solving complex differential equations arising in science and engineering applications. Alternative to traditional numerical schemes, learning-based solvers utilize the representation power of DNNs to approximate the input-output relations in an automated manner. However, the lack of physics-in-the-loop often makes it difficult to construct a neural network solver that simultaneously achieves high accuracy, low computational burden, and interpretability. In this work, focusing on a class of evolutionary PDEs characterized by having decomposable operators, we show that the classical ``operator splitting'' numerical scheme of solving these equations can be exploited to design neural network architectures. This gives rise to a learning-based PDE solver, which we name Deep Operator-Splitting Network (DOSnet). Such non-black-box network design is constructed from the physical rules and operators governing the underlying dynamics contains learnable parameters, and is thus more flexible than the standard operator splitting scheme. Once trained, it enables the fast solution of the same type of PDEs. To validate the special structure inside DOSnet, we take the linear PDEs as the benchmark and give the mathematical explanation for the weight behavior. Furthermore, to demonstrate the advantages of our new AI-enhanced PDE solver, we train and validate it on several types of operator-decomposable differential equations. We also apply DOSnet to nonlinear Schr\"odinger equations (NLSE) which have important applications in the signal processing for modern optical fiber transmission systems, and experimental results show that our model has better accuracy and lower computational complexity than numerical schemes and the baseline DNNs.

Non-Pharmaceutical Interventions (NPIs), such as social gathering restrictions, have shown effectiveness to slow the transmission of COVID-19 by reducing the contact of people. To support policy-makers, multiple studies have first modeled human mobility via macro indicators (e.g., average daily travel distance) and then studied the effectiveness of NPIs. In this work, we focus on mobility modeling and, from a micro perspective, aim to predict locations that will be visited by COVID-19 cases. Since NPIs generally cause economic and societal loss, such a micro perspective prediction benefits governments when they design and evaluate them. However, in real-world situations, strict privacy data protection regulations result in severe data sparsity problems (i.e., limited case and location information). To address these challenges, we formulate the micro perspective mobility modeling into computing the relevance score between a diffusion and a location, conditional on a geometric graph. we propose a model named Deep Graph Diffusion Infomax (DGDI), which jointly models variables including a geometric graph, a set of diffusions and a set of locations.To facilitate the research of COVID-19 prediction, we present two benchmarks that contain geometric graphs and location histories of COVID-19 cases. Extensive experiments on the two benchmarks show that DGDI significantly outperforms other competing methods.

Online ride-hailing services have become a prevalent transportation system across the world. In this paper, we study a challenging problem of how to direct vacant taxis around a city such that supplies and demands can be balanced in online ride-hailing services. We design a new reward scheme that considers multiple performance metrics of online ride-hailing services. We also propose a novel deep reinforcement learning method named Deep-Q-Network with Action Mask (AM-DQN) masking off unnecessary actions in various locations such that agents can learn much faster and more efficiently. We conduct extensive experiments using a city-scale dataset from Chicago. Several popular heuristic and learning methods are also implemented as baselines for comparison. The results of the experiments show that the AM-DQN attains the best performances of all methods with respect to average failure rate, average waiting time for customers, and average idle search time for vacant taxis.

A deep learning strategy is developed for fast and accurate gas property measurements using flame emission spectroscopy (FES). Particularly, the short-gated fast FES is essential to resolve fast-evolving combustion behaviors. However, as the exposure time for capturing the flame emission spectrum gets shorter, the signal-to-noise ratio (SNR) decreases, and characteristic spectral features indicating the gas properties become relatively weaker. Then, the property estimation based on the short-gated spectrum is difficult and inaccurate. Denoising convolutional neural networks (CNN) can enhance the SNR of the short-gated spectrum. A new CNN architecture including a reversible down- and up-sampling (DU) operator and a loss function based on proper orthogonal decomposition (POD) coefficients is proposed. For training and testing the CNN, flame chemiluminescence spectra were captured from a stable methane-air flat flame using a portable spectrometer (spectral range: 250 - 850 nm, resolution: 0.5 nm) with varied equivalence ratio (0.8 - 1.2), pressure (1 - 10 bar), and exposure time (0.05, 0.2, 0.4, and 2 s). The long exposure (2 s) spectra were used as the ground truth when training the denoising CNN. A kriging model with POD is trained by the long-gated spectra for calibration, and then the prediction of the gas properties taking the denoised short-gated spectrum as the input: The property prediction errors of pressure and equivalence ratio were remarkably lowered in spite of the low SNR attendant with reduced exposure.

Safety comes first in many real-world applications involving autonomous agents. Despite a large number of reinforcement learning (RL) methods focusing on safety-critical tasks, there is still a lack of high-quality evaluation of those algorithms that adheres to safety constraints at each decision step under complex and unknown dynamics. In this paper, we revisit prior work in this scope from the perspective of state-wise safe RL and categorize them as projection-based, recovery-based, and optimization-based approaches, respectively. Furthermore, we propose Unrolling Safety Layer (USL), a joint method that combines safety optimization and safety projection. This novel technique explicitly enforces hard constraints via the deep unrolling architecture and enjoys structural advantages in navigating the trade-off between reward improvement and constraint satisfaction. To facilitate further research in this area, we reproduce related algorithms in a unified pipeline and incorporate them into SafeRL-Kit, a toolkit that provides off-the-shelf interfaces and evaluation utilities for safety-critical tasks. We then perform a comparative study of the involved algorithms on six benchmarks ranging from robotic control to autonomous driving. The empirical results provide an insight into their applicability and robustness in learning zero-cost-return policies without task-dependent handcrafting. The project page is available at https://sites.google.com/view/saferlkit.

We describe an algorithm that learns two-layer residual units using rectified linear unit (ReLU) activation: suppose the input $\mathbf{x}$ is from a distribution with support space $\mathbb{R}^d$ and the ground-truth generative model is a residual unit of this type, given by $\mathbf{y} = \boldsymbol{B}^\ast\left[\left(\boldsymbol{A}^\ast\mathbf{x}\right)^+ + \mathbf{x}\right]$, where ground-truth network parameters $\boldsymbol{A}^\ast \in \mathbb{R}^{d\times d}$ represent a full-rank matrix with nonnegative entries and $\boldsymbol{B}^\ast \in \mathbb{R}^{m\times d}$ is full-rank with $m \geq d$ and for $\boldsymbol{c} \in \mathbb{R}^d$, $[\boldsymbol{c}^{+}]_i = \max\{0, c_i\}$. We design layer-wise objectives as functionals whose analytic minimizers express the exact ground-truth network in terms of its parameters and nonlinearities. Following this objective landscape, learning residual units from finite samples can be formulated using convex optimization of a nonparametric function: for each layer, we first formulate the corresponding empirical risk minimization (ERM) as a positive semi-definite quadratic program (QP), then we show the solution space of the QP can be equivalently determined by a set of linear inequalities, which can then be efficiently solved by linear programming (LP). We further prove the strong statistical consistency of our algorithm, and demonstrate its robustness and sample efficiency through experimental results on synthetic data and a set of benchmark regression datasets.

Although machine learning based algorithms have been extensively used for detecting phishing websites, there has been relatively little work on how adversaries may attack such "phishing detectors" (PDs for short). In this paper, we propose a set of Gray-Box attacks on PDs that an adversary may use which vary depending on the knowledge that he has about the PD. We show that these attacks severely degrade the effectiveness of several existing PDs. We then propose the concept of operation chains that iteratively map an original set of features to a new set of features and develop the "Protective Operation Chain" (POC for short) algorithm. POC leverages the combination of random feature selection and feature mappings in order to increase the attacker's uncertainty about the target PD. Using 3 existing publicly available datasets plus a fourth that we have created and will release upon the publication of this paper, we show that POC is more robust to these attacks than past competing work, while preserving predictive performance when no adversarial attacks are present. Moreover, POC is robust to attacks on 13 different classifiers, not just one. These results are shown to be statistically significant at the p < 0.001 level.

This paper presents SVAM (Sequential Variance-Altered MLE), a unified framework for learning generalized linear models under adversarial label corruption in training data. SVAM extends to tasks such as least squares regression, logistic regression, and gamma regression, whereas many existing works on learning with label corruptions focus only on least squares regression. SVAM is based on a novel variance reduction technique that may be of independent interest and works by iteratively solving weighted MLEs over variance-altered versions of the GLM objective. SVAM offers provable model recovery guarantees superior to the state-of-the-art for robust regression even when a constant fraction of training labels are adversarially corrupted. SVAM also empirically outperforms several existing problem-specific techniques for robust regression and classification. Code for SVAM is available at https://github.com/purushottamkar/svam/

Sleep is an essential behavior to prevent the decrement of cognitive, motor, and emotional performance and various diseases. However, it is not easy to fall asleep when people want to sleep. There are various sleep-disturbing factors such as the COVID-19 situation, noise from outside, and light during the night. We aim to develop a personalized sleep induction system based on mental states using electroencephalogram and auditory stimulation. Our system analyzes users' mental states using an electroencephalogram and results of the Pittsburgh sleep quality index and Brunel mood scale. According to mental states, the system plays sleep induction sound among five auditory stimulation: white noise, repetitive beep sounds, rainy sound, binaural beat, and sham sound. Finally, the sleep-inducing system classified the sleep stage of participants with 94.7 percent and stopped auditory stimulation if participants showed non-rapid eye movement sleep. Our system makes 18 participants fall asleep among 20 participants.

The research on text summarization for low-resource Indian languages has been limited due to the availability of relevant datasets. This paper presents a summary of various deep-learning approaches used for the ILSUM 2022 Indic language summarization datasets. The ISUM 2022 dataset consists of news articles written in Indian English, Hindi, and Gujarati respectively, and their ground-truth summarizations. In our work, we explore different pre-trained seq2seq models and fine-tune those with the ILSUM 2022 datasets. In our case, the fine-tuned SoTA PEGASUS model worked the best for English, the fine-tuned IndicBART model with augmented data for Hindi, and again fine-tuned PEGASUS model along with a translation mapping-based approach for Gujarati. Our scores on the obtained inferences were evaluated using ROUGE-1, ROUGE-2, and ROUGE-4 as the evaluation metrics.

Federated learning enables cooperative training among massively distributed clients by sharing their learned local model parameters. However, with increasing model size, deploying federated learning requires a large communication bandwidth, which limits its deployment in wireless networks. To address this bottleneck, we introduce a residual-based federated learning framework (ResFed), where residuals rather than model parameters are transmitted in communication networks for training. In particular, we integrate two pairs of shared predictors for the model prediction in both server-to-client and client-to-server communication. By employing a common prediction rule, both locally and globally updated models are always fully recoverable in clients and the server. We highlight that the residuals only indicate the quasi-update of a model in a single inter-round, and hence contain more dense information and have a lower entropy than the model, comparing to model weights and gradients. Based on this property, we further conduct lossy compression of the residuals by sparsification and quantization and encode them for efficient communication. The experimental evaluation shows that our ResFed needs remarkably less communication costs and achieves better accuracy by leveraging less sensitive residuals, compared to standard federated learning. For instance, to train a 4.08 MB CNN model on CIFAR-10 with 10 clients under non-independent and identically distributed (Non-IID) setting, our approach achieves a compression ratio over 700X in each communication round with minimum impact on the accuracy. To reach an accuracy of 70%, it saves around 99% of the total communication volume from 587.61 Mb to 6.79 Mb in up-streaming and to 4.61 Mb in down-streaming on average for all clients.

Automated decision support systems promise to help human experts solve tasks more efficiently and accurately. However, existing systems typically require experts to understand when to cede agency to the system or when to exercise their own agency. Moreover, if the experts develop a misplaced trust in the system, their performance may worsen. In this work, we lift the above requirement and develop automated decision support systems that, by design, do not require experts to understand when each of their recommendations is accurate to improve their performance. To this end, we focus on multiclass classification tasks and consider an automated decision support system that, for each data sample, uses a classifier to recommend a subset of labels to a human expert. We first show that, by looking at the design of such a system from the perspective of conformal prediction, we can ensure that the probability that the recommended subset of labels contains the true label matches almost exactly a target probability value with high probability. Then, we develop an efficient and near-optimal search method to find the target probability value under which the expert benefits the most from using our system. Experiments on synthetic and real data demonstrate that our system can help the experts make more accurate predictions and is robust to the accuracy of the classifier it relies on.

Recent advancements in sensing and communication facilitate obtaining high-frequency real-time data from various physical systems like power networks, climate systems, biological networks, etc. However, since the data are recorded by physical sensors, it is natural that the obtained data is corrupted by measurement noise. In this paper, we present a novel algorithm for online real-time learning of dynamical systems from noisy time-series data, which employs the Robust Koopman operator framework to mitigate the effect of measurement noise. The proposed algorithm has three main advantages: a) it allows for online real-time monitoring of a dynamical system; b) it obtains a linear representation of the underlying dynamical system, thus enabling the user to use linear systems theory for analysis and control of the system; c) it is computationally fast and less intensive than the popular Extended Dynamic Mode Decomposition (EDMD) algorithm. We illustrate the efficiency of the proposed algorithm by applying it to identify the Van der Pol oscillator, the IEEE 68 bus system, and a ring network of Van der Pol oscillators.

Diffusion models are state-of-the-art deep learning empowered generative models that are trained based on the principle of learning forward and reverse diffusion processes via progressive noise-addition and denoising. To gain a better understanding of the limitations and potential risks, this paper presents the first study on the robustness of diffusion models against backdoor attacks. Specifically, we propose BadDiffusion, a novel attack framework that engineers compromised diffusion processes during model training for backdoor implantation. At the inference stage, the backdoored diffusion model will behave just like an untampered generator for regular data inputs, while falsely generating some targeted outcome designed by the bad actor upon receiving the implanted trigger signal. Such a critical risk can be dreadful for downstream tasks and applications built upon the problematic model. Our extensive experiments on various backdoor attack settings show that BadDiffusion can consistently lead to compromised diffusion models with high utility and target specificity. Even worse, BadDiffusion can be made cost-effective by simply finetuning a clean pre-trained diffusion model to implant backdoors. We also explore some possible countermeasures for risk mitigation. Our results call attention to potential risks and possible misuse of diffusion models.

Scoring rules promote rational and good decision making and predictions by models, this is increasingly important for automated procedures of `auto-ML'. The Brier score and Log loss are well-established scoring rules for classification and regression and possess the `strict properness' property that encourages optimal predictions. In this paper we survey proposed scoring rules for survival analysis, establish the first clear definition of `(strict) properness' for survival scoring rules, and determine which losses are proper and improper. We prove that commonly utilised scoring rules that are claimed to be proper are in fact improper. We further prove that under a strict set of assumptions a class of scoring rules is strictly proper for, what we term, `approximate' survival losses. We hope these findings encourage further research into robust validation of survival models and promote honest evaluation.

Estimating the effect of intervention from observational data while accounting for confounding variables is a key task in causal inference. Oftentimes, the confounders are unobserved, but we have access to large amounts of additional unstructured data (images, text) that contain valuable proxy signal about the missing confounders. This paper argues that leveraging this unstructured data can greatly improve the accuracy of causal effect estimation. Specifically, we introduce deep multi-modal structural equations, a generative model for causal effect estimation in which confounders are latent variables and unstructured data are proxy variables. This model supports multiple multi-modal proxies (images, text) as well as missing data. We empirically demonstrate that our approach outperforms existing methods based on propensity scores and corrects for confounding using unstructured inputs on tasks in genomics and healthcare. Our methods can potentially support the use of large amounts of data that were previously not used in causal inference

In recent years, the number of parameters of one deep learning (DL) model has been growing much faster than the growth of GPU memory space. People who are inaccessible to a large number of GPUs resort to heterogeneous training systems for storing model parameters in CPU memory. Existing heterogeneous systems are based on parallelization plans in the scope of the whole model. They apply a consistent parallel training method for all the operators in the computation. Therefore, engineers need to pay a huge effort to incorporate a new type of model parallelism and patch its compatibility with other parallelisms. For example, Mixture-of-Experts (MoE) is still incompatible with ZeRO-3 in Deepspeed. Also, current systems face efficiency problems on small scale, since they are designed and tuned for large-scale training. In this paper, we propose Elixir, a new parallel heterogeneous training system, which is designed for efficiency and flexibility. Elixir utilizes memory resources and computing resources of both GPU and CPU. For flexibility, Elixir generates parallelization plans in the granularity of operators. Any new type of model parallelism can be incorporated by assigning a parallel pattern to the operator. For efficiency, Elixir implements a hierarchical distributed memory management scheme to accelerate inter-GPU communications and CPU-GPU data transmissions. As a result, Elixir can train a 30B OPT model on an A100 with 40GB CUDA memory, meanwhile reaching 84% efficiency of Pytorch GPU training. With its super-linear scalability, the training efficiency becomes the same as Pytorch GPU training on multiple GPUs. Also, large MoE models can be trained 5.3x faster than dense models of the same size. Now Elixir is integrated into ColossalAI and is available on its main branch.

Artificial intelligence (AI) technologies revolutionize vast fields of society. Humans using these systems are likely to expect them to work in a potentially hyperrational manner. However, in this study, we show that some AI systems, namely large language models (LLMs), exhibit behavior that strikingly resembles human-like intuition - and the many cognitive errors that come with them. We use a state-of-the-art LLM, namely the latest iteration of OpenAI's Generative Pre-trained Transformer (GPT-3.5), and probe it with the Cognitive Reflection Test (CRT) as well as semantic illusions that were originally designed to investigate intuitive decision-making in humans. Our results show that GPT-3.5 systematically exhibits "machine intuition," meaning that it produces incorrect responses that are surprisingly equal to how humans respond to the CRT as well as to semantic illusions. We investigate several approaches to test how sturdy GPT-3.5's inclination for intuitive-like decision-making is. Our study demonstrates that investigating LLMs with methods from cognitive science has the potential to reveal emergent traits and adjust expectations regarding their machine behavior.

Warning: this paper contains content that may be offensive or upsetting. In the current context where online platforms have been effectively weaponized in a variety of geo-political events and social issues, Internet memes make fair content moderation at scale even more difficult. Existing work on meme classification and tracking has focused on black-box methods that do not explicitly consider the semantics of the memes or the context of their creation. In this paper, we pursue a modular and explainable architecture for Internet meme understanding. We design and implement multimodal classification methods that perform example- and prototype-based reasoning over training cases, while leveraging both textual and visual SOTA models to represent the individual cases. We study the relevance of our modular and explainable models in detecting harmful memes on two existing tasks: Hate Speech Detection and Misogyny Classification. We compare the performance between example- and prototype-based methods, and between text, vision, and multimodal models, across different categories of harmfulness (e.g., stereotype and objectification). We devise a user-friendly interface that facilitates the comparative analysis of examples retrieved by all of our models for any given meme, informing the community about the strengths and limitations of these explainable methods.

This paper first constructs a typical solution of ResNets for multi-category classifications by the principle of gate-network controls and deep-layer classifications, from which a general interpretation of the ResNet architecture is given and the performance mechanism is explained. We then use more solutions to further demonstrate the generality of that interpretation. The universal-approximation capability of ResNets is proved.

Graph processing applications are severely bottlenecked by memory system performance due to low data reuse and irregular memory accesses. While state-of-the-art prefetchers using Machine Learning (ML) have made great progress, they do not perform well on graph analytics applications due to phase transitions in the execution and irregular data access that is hard to predict. We propose MPGraph: a novel ML-based Prefetcher for Graph analytics. MPGraph makes three novel optimizations based on domain knowledge of graph analytics. It detects the transition of graph processing phases during execution using a novel soft detection technique, predicts memory accesses and pages using phase-specific multi-modality predictors, and prefetches using a novel chain spatio-temporal prefetching strategy. We evaluate our approach using three widely-used graph processing frameworks and a variety of graph datasets. Our approach achieves 34.17%-82.15% higher precision in phase transition detection than the KSWIN and decision tree baselines. Our predictors achieve 6.80%-16.02% higher F1-score for access prediction and 11.68%-15.41% higher accuracy-at-10 for page prediction compared with the baselines LSTM-based and vanilla attention-based models. Simulations show that MPGraph achieves on the average 87.16% (prefetch accuracy) and 73.29% (prefetch coverage), leading to 12.52%-21.23% IPC improvement. It outperforms the widely-used non-ML prefetcher BO by 7.58%-12.03%, and outperforms state-of-the-art ML-based prefetchers Voyager by 3.27%-4.42% and TransFetch by 3.73%-4.58% with respect to IPC improvement.

Gaussian Mixture Models (GMM) are one of the most potent parametric density estimators based on the kernel model that finds application in many scientific domains. In recent years, with the dramatic enlargement of data sources, typical machine learning algorithms, e.g. Expectation Maximization (EM), encounters difficulty with high-dimensional and streaming data. Moreover, complicated densities often demand a large number of Gaussian components. This paper proposes a fast online parameter estimation algorithm for GMM by using first-order stochastic optimization. This approach provides a framework to cope with the challenges of GMM when faced with high-dimensional streaming data and complex densities by leveraging the flexibly-tied factorization of the covariance matrix. A new stochastic Manifold optimization algorithm that preserves the orthogonality is introduced and used along with the well-known Euclidean space numerical optimization. Numerous empirical results on both synthetic and real datasets justify the effectiveness of our proposed stochastic method over EM-based methods in the sense of better-converged maximum for likelihood function, fewer number of needed epochs for convergence, and less time consumption per epoch.

Common measures of brain functional connectivity (FC) including covariance and correlation matrices are semi-positive definite (SPD) matrices residing on a cone-shape Riemannian manifold. Despite its remarkable success for Euclidean-valued data generation, use of standard generative adversarial networks (GANs) to generate manifold-valued FC data neglects its inherent SPD structure and hence the inter-relatedness of edges in real FC. We propose a novel graph-regularized manifold-aware conditional Wasserstein GAN (GR-SPD-GAN) for FC data generation on the SPD manifold that can preserve the global FC structure. Specifically, we optimize a generalized Wasserstein distance between the real and generated SPD data under an adversarial training, conditioned on the class labels. The resulting generator can synthesize new SPD-valued FC matrices associated with different classes of brain networks, e.g., brain disorder or healthy control. Furthermore, we introduce additional population graph-based regularization terms on both the SPD manifold and its tangent space to encourage the generator to respect the inter-subject similarity of FC patterns in the real data. This also helps in avoiding mode collapse and produces more stable GAN training. Evaluated on resting-state functional magnetic resonance imaging (fMRI) data of major depressive disorder (MDD), qualitative and quantitative results show that the proposed GR-SPD-GAN clearly outperforms several state-of-the-art GANs in generating more realistic fMRI-based FC samples. When applied to FC data augmentation for MDD identification, classification models trained on augmented data generated by our approach achieved the largest margin of improvement in classification accuracy among the competing GANs over baselines without data augmentation.

Simulating quantum channels is a fundamental primitive in quantum computing, since quantum channels define general (trace-preserving) quantum operations. An arbitrary quantum channel cannot be exactly simulated using a finite-dimensional programmable quantum processor, making it important to develop optimal approximate simulation techniques. In this paper, we study the challenging setting in which the channel to be simulated varies adversarially with time. We propose the use of matrix exponentiated gradient descent (MEGD), an online convex optimization method, and analytically show that it achieves a sublinear regret in time. Through experiments, we validate the main results for time-varying dephasing channels using a programmable generalized teleportation processor.

The key to electroencephalography (EEG)-based brain-computer interface (BCI) lies in neural decoding, and its accuracy can be improved by using hybrid BCI paradigms, that is, fusing multiple paradigms. However, hybrid BCIs usually require separate processing processes for EEG signals in each paradigm, which greatly reduces the efficiency of EEG feature extraction and the generalizability of the model. Here, we propose a two-stream convolutional neural network (TSCNN) based hybrid brain-computer interface. It combines steady-state visual evoked potential (SSVEP) and motor imagery (MI) paradigms. TSCNN automatically learns to extract EEG features in the two paradigms in the training process, and improves the decoding accuracy by 25.4% compared with the MI mode, and 2.6% compared with SSVEP mode in the test data. Moreover, the versatility of TSCNN is verified as it provides considerable performance in both single-mode (70.2% for MI, 93.0% for SSVEP) and hybrid-mode scenarios (95.6% for MI-SSVEP hybrid). Our work will facilitate the real-world applications of EEG-based BCI systems.

The mixture of Expert (MoE) parallelism is a recent advancement that scales up the model size with constant computational cost. MoE selects different sets of parameters (i.e., experts) for each incoming token, resulting in a sparsely-activated model. Despite several successful applications of MoE, its training efficiency degrades significantly as the number of experts increases. The routing stage in MoE relies on the efficiency of the All2All communication collective, which suffers from network congestion and has poor scalability. To mitigate these issues, we introduce SMILE, which exploits heterogeneous network bandwidth and splits a single-step routing into bi-level routing. Our experimental results show that the proposed method obtains a 2.5x speedup over Switch Transformer in terms of pretraining throughput on the Colossal Clean Crawled Corpus without losing any convergence speed.

In model extraction attacks, adversaries can steal a machine learning model exposed via a public API by repeatedly querying it and adjusting their own model based on obtained predictions. To prevent model stealing, existing defenses focus on detecting malicious queries, truncating, or distorting outputs, thus necessarily introducing a tradeoff between robustness and model utility for legitimate users. Instead, we propose to impede model extraction by requiring users to complete a proof-of-work before they can read the model's predictions. This deters attackers by greatly increasing (even up to 100x) the computational effort needed to leverage query access for model extraction. Since we calibrate the effort required to complete the proof-of-work to each query, this only introduces a slight overhead for regular users (up to 2x). To achieve this, our calibration applies tools from differential privacy to measure the information revealed by a query. Our method requires no modification of the victim model and can be applied by machine learning practitioners to guard their publicly exposed models against being easily stolen.

Many sequential decision making problems, including pool-based active learning and adaptive viral marketing, can be formulated as an adaptive submodular maximization problem. Most of existing studies on adaptive submodular optimization focus on either monotone case or non-monotone case. Specifically, if the utility function is monotone and adaptive submodular, \cite{golovin2011adaptive} developed a greedy policy that achieves a $(1-1/e)$ approximation ratio subject to a cardinality constraint. If the utility function is non-monotone and adaptive submodular, \cite{tang2021beyond} showed that a random greedy policy achieves a $1/e$ approximation ratio subject to a cardinality constraint. In this work, we aim to generalize the above mentioned results by studying the partial-monotone adaptive submodular maximization problem. To this end, we introduce the notation of adaptive monotonicity ratio $m\in[0,1]$ to measure the degree of monotonicity of a function. Our main result is to show that a random greedy policy achieves an approximation ratio of $m(1-1/e)+(1-m)(1/e)$ if the utility function is $m$-adaptive monotone and adaptive submodular. Notably this result recovers the aforementioned $(1-1/e)$ and $1/e$ approximation ratios when $m = 0$ and $m = 1$, respectively. We further extend our results to consider a knapsack constraint. We show that a sampling-based policy achieves an approximation ratio of $(m+1)/10$ if the utility function is $m$-adaptive monotone and adaptive submodular. One important implication of our results is that even for a non-monotone utility function, we still can achieve an approximation ratio close to $(1-1/e)$ if this function is ``close'' to a monotone function. This leads to improved performance bounds for many machine learning applications whose utility functions are almost adaptive monotone.

We propose a model-data asymptotic-preserving neural network(MD-APNN) method to solve the nonlinear gray radiative transfer equations(GRTEs). The system is challenging to be simulated with both the traditional numerical schemes and the vanilla physics-informed neural networks(PINNs) due to the multiscale characteristics. Under the framework of PINNs, we employ a micro-macro decomposition technique to construct a new asymptotic-preserving(AP) loss function, which includes the residual of the governing equations in the micro-macro coupled form, the initial and boundary conditions with additional diffusion limit information, the conservation laws, and a few labeled data. A convergence analysis is performed for the proposed method, and a number of numerical examples are presented to illustrate the efficiency of MD-APNNs, and particularly, the importance of the AP property in the neural networks for the diffusion dominating problems. The numerical results indicate that MD-APNNs lead to a better performance than APNNs or pure data-driven networks in the simulation of the nonlinear non-stationary GRTEs.

Distributed Stein Variational Gradient Descent (DSVGD) is a non-parametric distributed learning framework for federated Bayesian learning, where multiple clients jointly train a machine learning model by communicating a number of non-random and interacting particles with the server. Since communication resources are limited, selecting the clients with most informative local learning updates can improve the model convergence and communication efficiency. In this paper, we propose two selection schemes for DSVGD based on Kernelized Stein Discrepancy (KSD) and Hilbert Inner Product (HIP). We derive the upper bound on the decrease of the global free energy per iteration for both schemes, which is then minimized to speed up the model convergence. We evaluate and compare our schemes with conventional schemes in terms of model accuracy, convergence speed, and stability using various learning tasks and datasets.

In the classical setting of self-selection, the goal is to learn $k$ models, simultaneously from observations $(x^{(i)}, y^{(i)})$ where $y^{(i)}$ is the output of one of $k$ underlying models on input $x^{(i)}$. In contrast to mixture models, where we observe the output of a randomly selected model, here the observed model depends on the outputs themselves, and is determined by some known selection criterion. For example, we might observe the highest output, the smallest output, or the median output of the $k$ models. In known-index self-selection, the identity of the observed model output is observable; in unknown-index self-selection, it is not. Self-selection has a long history in Econometrics and applications in various theoretical and applied fields, including treatment effect estimation, imitation learning, learning from strategically reported data, and learning from markets at disequilibrium. In this work, we present the first computationally and statistically efficient estimation algorithms for the most standard setting of this problem where the models are linear. In the known-index case, we require poly$(1/\varepsilon, k, d)$ sample and time complexity to estimate all model parameters to accuracy $\varepsilon$ in $d$ dimensions, and can accommodate quite general selection criteria. In the more challenging unknown-index case, even the identifiability of the linear models (from infinitely many samples) was not known. We show three results in this case for the commonly studied $\max$ self-selection criterion: (1) we show that the linear models are indeed identifiable, (2) for general $k$ we provide an algorithm with poly$(d) \exp(\text{poly}(k))$ sample and time complexity to estimate the regression parameters up to error $1/\text{poly}(k)$, and (3) for $k = 2$ we provide an algorithm for any error $\varepsilon$ and poly$(d, 1/\varepsilon)$ sample and time complexity.

Datacenter operators ensure fair and regular server maintenance by using automated processes to schedule maintenance jobs to complete within a strict time budget. Automating this scheduling problem is challenging because maintenance job duration varies based on both job type and hardware. While it is tempting to use prior machine learning techniques for predicting job duration, we find that the structure of the maintenance job scheduling problem creates a unique challenge. In particular, we show that prior machine learning methods that produce the lowest error predictions do not produce the best scheduling outcomes due to asymmetric costs. Specifically, underpredicting maintenance job duration has results in more servers being taken offline and longer server downtime than overpredicting maintenance job duration. The system cost of underprediction is much larger than that of overprediction. We present Acela, a machine learning system for predicting maintenance job duration, which uses quantile regression to bias duration predictions toward overprediction. We integrate Acela into a maintenance job scheduler and evaluate it on datasets from large-scale, production datacenters. Compared to machine learning based predictors from prior work, Acela reduces the number of servers that are taken offline by 1.87-4.28X, and reduces the server offline time by 1.40-2.80X.

Although a recent shift has been made in the field of predictive process monitoring to use models from the explainable artificial intelligence field, the evaluation still occurs mainly through performance-based metrics, thus not accounting for the actionability and implications of the explanations. In this paper, we define explainability through the interpretability of the explanations and the faithfulness of the explainability model in the field of process outcome prediction. The introduced properties are analysed along the event, case, and control flow perspective which are typical for a process-based analysis. This allows comparing inherently created explanations with post-hoc explanations. We benchmark seven classifiers on thirteen real-life events logs, and these cover a range of transparent and non-transparent machine learning and deep learning models, further complemented with explainability techniques. Next, this paper contributes a set of guidelines named X-MOP which allows selecting the appropriate model based on the event log specifications, by providing insight into how the varying preprocessing, model complexity and explainability techniques typical in process outcome prediction influence the explainability of the model.

Speech translation (ST) is the task of directly translating acoustic speech signals in a source language into text in a foreign language. ST task has been addressed, for a long time, using a pipeline approach with two modules : first an Automatic Speech Recognition (ASR) in the source language followed by a text-to-text Machine translation (MT). In the past few years, we have seen a paradigm shift towards the end-to-end approaches using sequence-to-sequence deep neural network models. This paper presents our efforts towards the development of the first Broadcast News end-to-end Arabic to English speech translation system. Starting from independent ASR and MT LDC releases, we were able to identify about 92 hours of Arabic audio recordings for which the manual transcription was also translated into English at the segment level. These data was used to train and compare pipeline and end-to-end speech translation systems under multiple scenarios including transfer learning and data augmentation techniques.

In this paper, we propose a control synthesis method for signal temporal logic (STL) specifications with neural networks (NNs). Most of the previous works consider training a controller for only a given STL specification. These approaches, however, require retraining the NN controller if a new specification arises and needs to be satisfied, which results in large consumption of memory and inefficient training. To tackle this problem, we propose to construct NN controllers by introducing encoder-decoder structured NNs with an attention mechanism. The encoder takes an STL formula as input and encodes it into an appropriate vector, and the decoder outputs control signals that will meet the given specification. As the encoder, we consider three NN structures: sequential, tree-structured, and graph-structured NNs. All the model parameters are trained in an end-to-end manner to maximize the expected robustness that is known to be a quantitative semantics of STL formulae. We compare the control performances attained by the above NN structures through a numerical experiment of the path planning problem, showing the efficacy of the proposed approach.

A reliable critic is central to on-policy actor-critic learning. But it becomes challenging to learn a reliable critic in a multi-agent sparse reward scenario due to two factors: 1) The joint action space grows exponentially with the number of agents 2) This, combined with the reward sparseness and environment noise, leads to large sample requirements for accurate learning. We show that regularising the critic with spectral normalization (SN) enables it to learn more robustly, even in multi-agent on-policy sparse reward scenarios. Our experiments show that the regularised critic is quickly able to learn from the sparse rewarding experience in the complex SMAC and RWARE domains. These findings highlight the importance of regularisation in the critic for stable learning.

Semantic segmentation is a high level computer vision task that assigns a label for each pixel of an image. It is challengeful to deal with extremely-imbalanced data in which the ratio of target ixels to background pixels is lower than 1:1000. Such severe input imbalance leads to output imbalance for poor model training. This paper considers three issues for extremely-imbalanced data: inspired by the region based loss, an implicit measure for the output imbalance is proposed, and an adaptive algorithm is designed for guiding the output imbalance hyperparameter selection; then it is generalized to distribution based loss for dealing with output imbalance; and finally a compound loss with our adaptive hyperparameter selection alogorithm can keep the consistency of training and inference for harmonizing the output imbalance. With four popular deep architectures on our private dataset with three input imbalance scales and three public datasets, extensive experiments demonstrate the ompetitive/promising performance of the proposed method.

Many real-world learning scenarios face the challenge of slow concept drift, where data distributions change gradually over time. In this setting, we pose the problem of learning temporally sensitive importance weights for training data, in order to optimize predictive accuracy. We propose a class of temporal reweighting functions that can capture multiple timescales of change in the data, as well as instance-specific characteristics. We formulate a bi-level optimization criterion, and an associated meta-learning algorithm, by which these weights can be learned. In particular, our formulation trains an auxiliary network to output weights as a function of training instances, thereby compactly representing the instance weights. We validate our temporal reweighting scheme on a large real-world dataset of 39M images spread over a 9 year period. Our extensive experiments demonstrate the necessity of instance-based temporal reweighting in the dataset, and achieve significant improvements to classical batch-learning approaches. Further, our proposal easily generalizes to a streaming setting and shows significant gains compared to recent continual learning methods.

Spectral risk objectives - also called $L$-risks - allow for learning systems to interpolate between optimizing average-case performance (as in empirical risk minimization) and worst-case performance on a task. We develop stochastic algorithms to optimize these quantities by characterizing their subdifferential and addressing challenges such as biasedness of subgradient estimates and non-smoothness of the objective. We show theoretically and experimentally that out-of-the-box approaches such as stochastic subgradient and dual averaging are hindered by bias and that our approach outperforms them.

Unsupervised domain adaptation (UDA) aims to transfer knowledge from a well-labeled source domain to a different but related unlabeled target domain with identical label space. Currently, the main workhorse for solving UDA is domain alignment, which has proven successful. However, it is often difficult to find an appropriate source domain with identical label space. A more practical scenario is so-called partial domain adaptation (PDA) in which the source label set or space subsumes the target one. Unfortunately, in PDA, due to the existence of the irrelevant categories in the source domain, it is quite hard to obtain a perfect alignment, thus resulting in mode collapse and negative transfer. Although several efforts have been made by down-weighting the irrelevant source categories, the strategies used tend to be burdensome and risky since exactly which irrelevant categories are unknown. These challenges motivate us to find a relatively simpler alternative to solve PDA. To achieve this, we first provide a thorough theoretical analysis, which illustrates that the target risk is bounded by both model smoothness and between-domain discrepancy. Considering the difficulty of perfect alignment in solving PDA, we turn to focus on the model smoothness while discard the riskier domain alignment to enhance the adaptability of the model. Specifically, we instantiate the model smoothness as a quite simple intra-domain structure preserving (IDSP). To our best knowledge, this is the first naive attempt to address the PDA without domain alignment. Finally, our empirical results on multiple benchmark datasets demonstrate that IDSP is not only superior to the PDA SOTAs by a significant margin on some benchmarks (e.g., +10% on Cl->Rw and +8% on Ar->Rw ), but also complementary to domain alignment in the standard UDA

The application of natural language processing (NLP) to cancer pathology reports has been focused on detecting cancer cases, largely ignoring precancerous cases. Improving the characterization of precancerous adenomas assists in developing diagnostic tests for early cancer detection and prevention, especially for colorectal cancer (CRC). Here we developed transformer-based deep neural network NLP models to perform the CRC phenotyping, with the goal of extracting precancerous lesion attributes and distinguishing cancer and precancerous cases. We achieved 0.914 macro-F1 scores for classifying patients into negative, non-advanced adenoma, advanced adenoma and CRC. We further improved the performance to 0.923 using an ensemble of classifiers for cancer status classification and lesion size named entity recognition (NER). Our results demonstrated the potential of using NLP to leverage real-world health record data to facilitate the development of diagnostic tests for early cancer prevention.

Randomly masking and predicting word tokens has been a successful approach in pre-training language models for a variety of downstream tasks. In this work, we observe that the same idea also applies naturally to sequential decision making, where many well-studied tasks like behavior cloning, offline RL, inverse dynamics, and waypoint conditioning correspond to different sequence maskings over a sequence of states, actions, and returns. We introduce the FlexiBiT framework, which provides a unified way to specify models which can be trained on many different sequential decision making tasks. We show that a single FlexiBiT model is simultaneously capable of carrying out many tasks with performance similar to or better than specialized models. Additionally, we show that performance can be further improved by fine-tuning our general model on specific tasks of interest.

Masked Language Modeling (MLM) has proven to be an essential component of Vision-Language (VL) pretraining. To implement MLM, the researcher must make two design choices: the masking strategy, which determines which tokens to mask, and the masking rate, which determines how many tokens to mask. Previous work has focused primarily on the masking strategy while setting the masking rate at a default of 15\%. In this paper, we show that increasing this masking rate improves downstream performance while simultaneously reducing performance gap among different masking strategies, rendering the uniform masking strategy competitive to other more complex ones. Surprisingly, we also discover that increasing the masking rate leads to gains in Image-Text Matching (ITM) tasks, suggesting that the role of MLM goes beyond language modeling in VL pretraining.

Poor sample efficiency continues to be the primary challenge for deployment of deep Reinforcement Learning (RL) algorithms for real-world applications, and in particular for visuo-motor control. Model-based RL has the potential to be highly sample efficient by concurrently learning a world model and using synthetic rollouts for planning and policy improvement. However, in practice, sample-efficient learning with model-based RL is bottlenecked by the exploration challenge. In this work, we find that leveraging just a handful of demonstrations can dramatically improve the sample-efficiency of model-based RL. Simply appending demonstrations to the interaction dataset, however, does not suffice. We identify key ingredients for leveraging demonstrations in model learning -- policy pretraining, targeted exploration, and oversampling of demonstration data -- which forms the three phases of our model-based RL framework. We empirically study three complex visuo-motor control domains and find that our method is 150%-250% more successful in completing sparse reward tasks compared to prior approaches in the low data regime (100K interaction steps, 5 demonstrations). Code and videos are available at: https://nicklashansen.github.io/modemrl

In deep neural learning, a discriminator trained on in-distribution (ID) samples may make high-confidence predictions on out-of-distribution (OOD) samples. This triggers a significant matter for robust, trustworthy and safe deep learning. The issue is primarily caused by the limited ID samples observable in training the discriminator when OOD samples are unavailable. We propose a general approach for \textit{fine-tuning discriminators by implicit generators} (FIG). FIG is grounded on information theory and applicable to standard discriminators without retraining. It improves the ability of a standard discriminator in distinguishing ID and OOD samples by generating and penalizing its specific OOD samples. According to the Shannon entropy, an energy-based implicit generator is inferred from a discriminator without extra training costs. Then, a Langevin dynamic sampler draws specific OOD samples for the implicit generator. Lastly, we design a regularizer fitting the design principle of the implicit generator to induce high entropy on those generated OOD samples. The experiments on different networks and datasets demonstrate that FIG achieves the state-of-the-art OOD detection performance.

Estimating information-theoretic quantities such as entropy and mutual information is central to many problems in statistics and machine learning, but challenging in high dimensions. This paper presents estimators of entropy via inference (EEVI), which deliver upper and lower bounds on many information quantities for arbitrary variables in a probabilistic generative model. These estimators use importance sampling with proposal distribution families that include amortized variational inference and sequential Monte Carlo, which can be tailored to the target model and used to squeeze true information values with high accuracy. We present several theoretical properties of EEVI and demonstrate scalability and efficacy on two problems from the medical domain: (i) in an expert system for diagnosing liver disorders, we rank medical tests according to how informative they are about latent diseases, given a pattern of observed symptoms and patient attributes; and (ii) in a differential equation model of carbohydrate metabolism, we find optimal times to take blood glucose measurements that maximize information about a diabetic patient's insulin sensitivity, given their meal and medication schedule.

Self-attentive transformer models have recently been shown to solve the next item recommendation task very efficiently. The learned attention weights capture sequential dynamics in user behavior and generalize well. Motivated by the special structure of learned parameter space, we question if it is possible to mimic it with an alternative and more lightweight approach. We develop a new tensor factorization-based model that ingrains the structural knowledge about sequential data within the learning process. We demonstrate how certain properties of a self-attention network can be reproduced with our approach based on special Hankel matrix representation. The resulting model has a shallow linear architecture and compares competitively to its neural counterpart.

Graph Neural Networks(GNNs) are a family of neural models tailored for graph-structure data and have shown superior performance in learning representations for graph-structured data. However, training GNNs on large graphs remains challenging and a promising direction is distributed GNN training, which is to partition the input graph and distribute the workload across multiple machines. The key bottleneck of the existing distributed GNNs training framework is the across-machine communication induced by the dependency on the graph data and aggregation operator of GNNs. In this paper, we study the communication complexity during distributed GNNs training and propose a simple lossless communication reduction method, termed the Aggregation before Communication (ABC) method. ABC method exploits the permutation-invariant property of the GNNs layer and leads to a paradigm where vertex-cut is proved to admit a superior communication performance than the currently popular paradigm (edge-cut). In addition, we show that the new partition paradigm is particularly ideal in the case of dynamic graphs where it is infeasible to control the edge placement due to the unknown stochastic of the graph-changing process.

A machine learning (ML) system must learn not only to match the output of a target function on a training set, but also to generalize to novel situations in order to yield accurate predictions at deployment. In most practical applications, the user cannot exhaustively enumerate every possible input to the model; strong generalization performance is therefore crucial to the development of ML systems which are performant and reliable enough to be deployed in the real world. While generalization is well-understood theoretically in a number of hypothesis classes, the impressive generalization performance of deep neural networks has stymied theoreticians. In deep reinforcement learning (RL), our understanding of generalization is further complicated by the conflict between generalization and stability in widely-used RL algorithms. This thesis will provide insight into generalization by studying the learning dynamics of deep neural networks in both supervised and reinforcement learning tasks.

Recurrent neural networks are capable of learning the dynamics of an unknown nonlinear system purely from input-output measurements. However, the resulting models do not provide any stability guarantees on the input-output mapping. In this work, we represent a recurrent neural network as a linear time-invariant system with nonlinear disturbances. By introducing constraints on the parameters, we can guarantee finite gain stability and incremental finite gain stability. We apply this identification method to learn the motion of a four-degrees-of-freedom ship that is moving in open water and compare it against other purely learning-based approaches with unconstrained parameters. Our analysis shows that the constrained recurrent neural network has a lower prediction accuracy on the test set, but it achieves comparable results on an out-of-distribution set and respects stability conditions.

Energy management systems (EMS) are becoming increasingly important in order to utilize the continuously growing curtailed renewable energy. Promising energy storage systems (ESS), such as batteries and green hydrogen should be employed to maximize the efficiency of energy stakeholders. However, optimal decision-making, i.e., planning the leveraging between different strategies, is confronted with the complexity and uncertainties of large-scale problems. Here, we propose a sophisticated deep reinforcement learning (DRL) methodology with a policy-based algorithm to realize the real-time optimal ESS planning under the curtailed renewable energy uncertainty. A quantitative performance comparison proved that the DRL agent outperforms the scenario-based stochastic optimization (SO) algorithm, even with a wide action and observation space. Owing to the uncertainty rejection capability of the DRL, we could confirm a robust performance, under a large uncertainty of the curtailed renewable energy, with a maximizing net profit and stable system. Action-mapping was performed for visually assessing the action taken by the DRL agent according to the state. The corresponding results confirmed that the DRL agent learns the way like what a human expert would do, suggesting reliable application of the proposed methodology.

Cardinality estimation is one of the most fundamental and challenging problems in query optimization. Neither classical nor learning-based methods yield satisfactory performance when estimating the cardinality of the join queries. They either rely on simplified assumptions leading to ineffective cardinality estimates or build large models to understand the data distributions, leading to long planning times and a lack of generalizability across queries. In this paper, we propose a new framework FactorJoin for estimating join queries. FactorJoin combines the idea behind the classical join-histogram method to efficiently handle joins with the learning-based methods to accurately capture attribute correlation. Specifically, FactorJoin scans every table in a DB and builds single-table conditional distributions during an offline preparation phase. When a join query comes, FactorJoin translates it into a factor graph model over the learned distributions to effectively and efficiently estimate its cardinality. Unlike existing learning-based methods, FactorJoin does not need to de-normalize joins upfront or require executed query workloads to train the model. Since it only relies on single-table statistics, FactorJoin has small space overhead and is extremely easy to train and maintain. In our evaluation, FactorJoin can produce more effective estimates than the previous state-of-the-art learning-based methods, with 40x less estimation latency, 100x smaller model size, and 100x faster training speed at comparable or better accuracy. In addition, FactorJoin can estimate 10,000 sub-plan queries within one second to optimize the query plan, which is very close to the traditional cardinality estimators in commercial DBMS.

At eBay, there are thousands of product health metrics for different domain teams to monitor. We built a two-phase alerting system to notify users with actionable alerts based on anomaly detection and alert retrieval. In the first phase, we developed an efficient anomaly detection algorithm, called Moving Metric Detector (MMD), to identify potential alerts among metrics with distribution agnostic criteria. In the second alert retrieval phase, we built additional logic with feedbacks to select valid actionable alerts with point-wise ranking model and business rules. Compared with other trend and seasonality decomposition methods, our decomposer is faster and better to detect anomalies in unsupervised cases. Our two-phase approach dramatically improves alert precision and avoids alert spamming in eBay production.

We generalize the classical universal approximation theorem for neural networks to the case of complex-valued neural networks. Precisely, we consider feedforward networks with a complex activation function $\sigma : \mathbb{C} \to \mathbb{C}$ in which each neuron performs the operation $\mathbb{C}^N \to \mathbb{C}, z \mapsto \sigma(b + w^T z)$ with weights $w \in \mathbb{C}^N$ and a bias $b \in \mathbb{C}$, and with $\sigma$ applied componentwise. We completely characterize those activation functions $\sigma$ for which the associated complex networks have the universal approximation property, meaning that they can uniformly approximate any continuous function on any compact subset of $\mathbb{C}^d$ arbitrarily well. Unlike the classical case of real networks, the set of "good activation functions" which give rise to networks with the universal approximation property differs significantly depending on whether one considers deep networks or shallow networks: For deep networks with at least two hidden layers, the universal approximation property holds as long as $\sigma$ is neither a polynomial, a holomorphic function, or an antiholomorphic function. Shallow networks, on the other hand, are universal if and only if the real part or the imaginary part of $\sigma$ is not a polyharmonic function.

Machine learning models are known to be susceptible to adversarial perturbation. One famous attack is the adversarial patch, a sticker with a particularly crafted pattern that makes the model incorrectly predict the object it is placed on. This attack presents a critical threat to cyber-physical systems that rely on cameras such as autonomous cars. Despite the significance of the problem, conducting research in this setting has been difficult; evaluating attacks and defenses in the real world is exceptionally costly while synthetic data are unrealistic. In this work, we propose the REAP (REalistic Adversarial Patch) benchmark, a digital benchmark that allows the user to evaluate patch attacks on real images, and under real-world conditions. Built on top of the Mapillary Vistas dataset, our benchmark contains over 14,000 traffic signs. Each sign is augmented with a pair of geometric and lighting transformations, which can be used to apply a digitally generated patch realistically onto the sign. Using our benchmark, we perform the first large-scale assessments of adversarial patch attacks under realistic conditions. Our experiments suggest that adversarial patch attacks may present a smaller threat than previously believed and that the success rate of an attack on simpler digital simulations is not predictive of its actual effectiveness in practice. We release our benchmark publicly at https://github.com/wagner-group/reap-benchmark.

Anomaly analytics is a popular and vital task in various research contexts, which has been studied for several decades. At the same time, deep learning has shown its capacity in solving many graph-based tasks like, node classification, link prediction, and graph classification. Recently, many studies are extending graph learning models for solving anomaly analytics problems, resulting in beneficial advances in graph-based anomaly analytics techniques. In this survey, we provide a comprehensive overview of graph learning methods for anomaly analytics tasks. We classify them into four categories based on their model architectures, namely graph convolutional network (GCN), graph attention network (GAT), graph autoencoder (GAE), and other graph learning models. The differences between these methods are also compared in a systematic manner. Furthermore, we outline several graph-based anomaly analytics applications across various domains in the real world. Finally, we discuss five potential future research directions in this rapidly growing field.

Reinforcement Learning (RL) can enable agents to learn complex tasks. However, it is difficult to interpret the knowledge and reuse it across tasks. Inductive biases can address such issues by explicitly providing generic yet useful decomposition that is otherwise difficult or expensive to learn implicitly. For example, object-centered approaches decompose a high dimensional observation into individual objects. Expanding on this, we utilize an inductive bias for explicit object-centered knowledge separation that provides further decomposition into semantic representations and dynamics knowledge. For this, we introduce a semantic module that predicts an objects' semantic state based on its context. The resulting affordance-like object state can then be used to enrich perceptual object representations. With a minimal setup and an environment that enables puzzle-like tasks, we demonstrate the feasibility and benefits of this approach. Specifically, we compare three different methods of integrating semantic representations into a model-based RL architecture. Our experiments show that the degree of explicitness in knowledge separation correlates with faster learning, better accuracy, better generalization, and better interpretability.

We introduce OPEND, a benchmark for learning how to use a hand to open cabinet doors or drawers in a photo-realistic and physics-reliable simulation environment driven by language instruction. To solve the task, we propose a multi-step planner composed of a deep neural network and rule-base controllers. The network is utilized to capture spatial relationships from images and understand semantic meaning from language instructions. Controllers efficiently execute the plan based on the spatial and semantic understanding. We evaluate our system by measuring its zero-shot performance in test data set. Experimental results demonstrate the effectiveness of decision planning by our multi-step planner for different hands, while suggesting that there is significant room for developing better models to address the challenge brought by language understanding, spatial reasoning, and long-term manipulation. We will release OPEND and host challenges to promote future research in this area.

Curated knowledge graphs encode domain expertise and improve the performance of recommendation, segmentation, ad targeting, and other machine learning systems in several domains. As new concepts emerge in a domain, knowledge graphs must be expanded to preserve machine learning performance. Manually expanding knowledge graphs, however, is infeasible at scale. In this work, we propose a method for knowledge graph expansion with humans-in-the-loop. Concretely, given a knowledge graph, our method predicts the "parents" of new concepts to be added to this graph for further verification by human experts. We show that our method is both accurate and provably "human-friendly". Specifically, we prove that our method predicts parents that are "near" concepts' true parents in the knowledge graph, even when the predictions are incorrect. We then show, with a controlled experiment, that satisfying this property increases both the speed and the accuracy of the human-algorithm collaboration. We further evaluate our method on a knowledge graph from Pinterest and show that it outperforms competing methods on both accuracy and human-friendliness. Upon deployment in production at Pinterest, our method reduced the time needed for knowledge graph expansion by ~400% (compared to manual expansion), and contributed to a subsequent increase in ad revenue of 20%.

Reverse engineers benefit from the presence of identifiers such as function names in a binary, but usually these are removed for release. Training a machine learning model to predict function names automatically is promising but fundamentally hard: unlike words in natural language, most function names occur only once. In this paper, we address this problem by introducing eXtreme Function Labeling (XFL), an extreme multi-label learning approach to selecting appropriate labels for binary functions. XFL splits function names into tokens, treating each as an informative label akin to the problem of tagging texts in natural language. We relate the semantics of binary code to labels through DEXTER, a novel function embedding that combines static analysis-based features with local context from the call graph and global context from the entire binary. We demonstrate that XFL/DEXTER outperforms the state of the art in function labeling on a dataset of 10,047 binaries from the Debian project, achieving a precision of 83.5%. We also study combinations of XFL with alternative binary embeddings from the literature and show that DEXTER consistently performs best for this task. As a result, we demonstrate that binary function labeling can be effectively phrased in terms of multi-label learning, and that binary function embeddings benefit from including explicit semantic features.

Polypharmacy, most often defined as the simultaneous consumption of five or more drugs at once, is a prevalent phenomenon in the older population. Some of these polypharmacies, deemed inappropriate, may be associated with adverse health outcomes such as death or hospitalization. Considering the combinatorial nature of the problem as well as the size of claims database and the cost to compute an exact association measure for a given drug combination, it is impossible to investigate every possible combination of drugs. Therefore, we propose to optimize the search for potentially inappropriate polypharmacies (PIPs). To this end, we propose the OptimNeuralTS strategy, based on Neural Thompson Sampling and differential evolution, to efficiently mine claims datasets and build a predictive model of the association between drug combinations and health outcomes. We benchmark our method using two datasets generated by an internally developed simulator of polypharmacy data containing 500 drugs and 100 000 distinct combinations. Empirically, our method can detect up to 33\% of PIPs while maintaining an average precision score of 99\% using 10 000 time steps.

We investigate algorithmic progress in image classification on ImageNet, perhaps the most well-known test bed for computer vision. We estimate a model, informed by work on neural scaling laws, and infer a decomposition of progress into the scaling of compute, data, and algorithms. Using Shapley values to attribute performance improvements, we find that algorithmic improvements have been roughly as important as the scaling of compute for progress computer vision. Our estimates indicate that algorithmic innovations mostly take the form of compute-augmenting algorithmic advances (which enable researchers to get better performance from less compute), not data-augmenting algorithmic advances. We find that compute-augmenting algorithmic advances are made at a pace more than twice as fast as the rate usually associated with Moore's law. In particular, we estimate that compute-augmenting innovations halve compute requirements every nine months (95\% confidence interval: 4 to 25 months).

In split machine learning (ML), different partitions of a neural network (NN) are executed by different computing nodes, requiring a large amount of communication cost. To ease communication burden, over-the-air computation (OAC) can efficiently implement all or part of the computation at the same time of communication. Based on the proposed system, the system implementation over wireless network is introduced and we provide the problem formulation. In particular, we show that the inter-layer connection in a NN of any size can be mathematically decomposed into a set of linear precoding and combining transformations over MIMO channels. Therefore, the precoding matrix at the transmitter and the combining matrix at the receiver of each MIMO link, as well as the channel matrix itself, can jointly serve as a fully connected layer of the NN. The generalization of the proposed scheme to the conventional NNs is also introduced. Finally, we extend the proposed scheme to the widely used convolutional neural networks and demonstrate its effectiveness under both the static and quasi-static memory channel conditions with comprehensive simulations. In such a split ML system, the precoding and combining matrices are regarded as trainable parameters, while MIMO channel matrix is regarded as unknown (implicit) parameters.

We present a novel approach to improve the performance of learning-based speech dereverberation using accurate synthetic datasets. Our approach is designed to recover the reverb-free signal from a reverberant speech signal. We show that accurately simulating the low-frequency components of Room Impulse Responses (RIRs) is important to achieving good dereverberation. We use the GWA dataset that consists of synthetic RIRs generated in a hybrid fashion: an accurate wave-based solver is used to simulate the lower frequencies and geometric ray tracing methods simulate the higher frequencies. We demonstrate that speech dereverberation models trained on hybrid synthetic RIRs outperform models trained on RIRs generated by prior geometric ray tracing methods on four real-world RIR datasets.

Continuous-time Markov chains are used to model stochastic systems where transitions can occur at irregular times, e.g., birth-death processes, chemical reaction networks, population dynamics, and gene regulatory networks. We develop a method to learn a continuous-time Markov chain's transition rate functions from fully observed time series. In contrast with existing methods, our method allows for transition rates to depend nonlinearly on both state variables and external covariates. The Gillespie algorithm is used to generate trajectories of stochastic systems where propensity functions (reaction rates) are known. Our method can be viewed as the inverse: given trajectories of a stochastic reaction network, we generate estimates of the propensity functions. While previous methods used linear or log-linear methods to link transition rates to covariates, we use neural networks, increasing the capacity and potential accuracy of learned models. In the chemical context, this enables the method to learn propensity functions from non-mass-action kinetics. We test our method with synthetic data generated from a variety of systems with known transition rates. We show that our method learns these transition rates with considerably more accuracy than log-linear methods, in terms of mean absolute error between ground truth and predicted transition rates. We also demonstrate an application of our methods to open-loop control of a continuous-time Markov chain.  ( 2 min )

In this paper, we propose a novel graph kernel, namely the Quantum-based Entropic Subtree Kernel (QESK), for Graph Classification. To this end, we commence by computing the Average Mixing Matrix (AMM) of the Continuous-time Quantum Walk (CTQW) evolved on each graph structure. Moreover, we show how this AMM matrix can be employed to compute a series of entropic subtree representations associated with the classical Weisfeiler-Lehman (WL) algorithm. For a pair of graphs, the QESK kernel is defined by computing the exponentiation of the negative Euclidean distance between their entropic subtree representations, theoretically resulting in a positive definite graph kernel. We show that the proposed QESK kernel not only encapsulates complicated intrinsic quantum-based structural characteristics of graph structures through the CTQW, but also theoretically addresses the shortcoming of ignoring the effects of unshared substructures arising in state-of-the-art R-convolution graph kernels. Moreover, unlike the classical R-convolution kernels, the proposed QESK can discriminate the distinctions of isomorphic subtrees in terms of the global graph structures, theoretically explaining the effectiveness. Experiments indicate that the proposed QESK kernel can significantly outperform state-of-the-art graph kernels and graph deep learning methods for graph classification problems.  ( 2 min )

Single-cell sequencing assay for transposase-accessible chromatin (scATAC-seq) assesses genome-wide chromatin accessibility in thousands of cells to reveal regulatory landscapes in high resolutions. However, the analysis presents challenges due to the high dimensionality and sparsity of the data. Several methods have been developed, including transformation techniques of term-frequency inverse-document frequency (TF-IDF), dimension reduction methods such as singular value decomposition (SVD), factor analysis, and autoencoders. Yet, a comprehensive study on the mentioned methods has not been fully performed. It is not clear what is the best practice when analyzing scATAC-seq data. We compared several scenarios for transformation and dimension reduction as well as the SVD-based feature analysis to investigate potential enhancements in scATAC-seq information retrieval. Additionally, we investigate if autoencoders benefit from the TF-IDF transformation. Our results reveal that the TF-IDF transformation generally leads to improved clustering and biologically relevant feature extraction.  ( 2 min )

Deep Reinforcement Learning (RL) agents are susceptible to adversarial noise in their observations that can mislead their policies and decrease their performance. However, an adversary may be interested not only in decreasing the reward, but also in modifying specific temporal logic properties of the policy. This paper presents a metric that measures the exact impact of adversarial attacks against such properties. We use this metric to craft optimal adversarial attacks. Furthermore, we introduce a model checking method that allows us to verify the robustness of RL policies against adversarial attacks. Our empirical analysis confirms (1) the quality of our metric to craft adversarial attacks against temporal logic properties, and (2) that we are able to concisely assess a system's robustness against attacks.  ( 2 min )

We identify the task of measuring data to quantitatively characterize the composition of machine learning data and datasets. Similar to an object's height, width, and volume, data measurements quantify different attributes of data along common dimensions that support comparison. Several lines of research have proposed what we refer to as measurements, with differing terminology; we bring some of this work together, particularly in fields of computer vision and language, and build from it to motivate measuring data as a critical component of responsible AI development. Measuring data aids in systematically building and analyzing machine learning (ML) data towards specific goals and gaining better control of what modern ML systems will learn. We conclude with a discussion of the many avenues of future work, the limitations of data measurements, and how to leverage these measurement approaches in research and practice.  ( 2 min )

Restless multi-armed bandits are often used to model budget-constrained resource allocation tasks where receipt of the resource is associated with an increased probability of a favorable state transition. Prior work assumes that individual arms only benefit if they receive the resource directly. However, many allocation tasks occur within communities and can be characterized by positive externalities that allow arms to derive partial benefit when their neighbor(s) receive the resource. We thus introduce networked restless bandits, a novel multi-armed bandit setting in which arms are both restless and embedded within a directed graph. We then present Greta, a graph-aware, Whittle index-based heuristic algorithm that can be used to efficiently construct a constrained reward-maximizing action vector at each timestep. Our empirical results demonstrate that Greta outperforms comparison policies across a range of hyperparameter values and graph topologies.  ( 2 min )

Developing robots that are capable of many skills and generalization to unseen scenarios requires progress on two fronts: efficient collection of large and diverse datasets, and training of high-capacity policies on the collected data. While large datasets have propelled progress in other fields like computer vision and natural language processing, collecting data of comparable scale is particularly challenging for physical systems like robotics. In this work, we propose a framework to bridge this gap and better scale up robot learning, under the lens of multi-task, multi-scene robot manipulation in kitchen environments. Our framework, named CACTI, has four stages that separately handle data collection, data augmentation, visual representation learning, and imitation policy training. In the CACTI framework, we highlight the benefit of adapting state-of-the-art models for image generation as part of the augmentation stage, and the significant improvement of training efficiency by using pretrained out-of-domain visual representations at the compression stage. Experimentally, we demonstrate that 1) on a real robot setup, CACTI enables efficient training of a single policy capable of 10 manipulation tasks involving kitchen objects, and robust to varying layouts of distractor objects; 2) in a simulated kitchen environment, CACTI trains a single policy on 18 semantic tasks across up to 50 layout variations per task. The simulation task benchmark and augmented datasets in both real and simulated environments will be released to facilitate future research.  ( 2 min )

Sparse matrix representations are ubiquitous in computational science and machine learning, leading to significant reductions in compute time, in comparison to dense representation, for problems that have local connectivity. The adoption of sparse representation in leading ML frameworks such as PyTorch is incomplete, however, with support for both automatic differentiation and GPU acceleration missing. In this work, we present an implementation of a CSR-based sparse matrix wrapper for PyTorch with CUDA acceleration for basic matrix operations, as well as automatic differentiability. We also present several applications of the resulting sparse kernels to optimization problems, demonstrating ease of implementation and performance measurements versus their dense counterparts.  ( 2 min )

Microfinance, despite its significant potential for poverty reduction, is facing sustainability hardships due to high default rates. Although many methods in regular finance can estimate credit scores and default probabilities, these methods are not directly applicable to microfinance due to the following unique characteristics: a) under-explored (developing) areas such as rural Africa do not have sufficient prior loan data for microfinance institutions (MFIs) to establish a credit scoring system; b) microfinance applicants may have difficulty providing sufficient information for MFIs to accurately predict default probabilities; and c) many MFIs use group liability (instead of collateral) to secure repayment. Here, we present a novel control-theoretic model of microfinance that accounts for these characteristics. We construct an algorithm to learn microfinance decision policies that achieve financial inclusion, fairness, social welfare, and sustainability. We characterize the convergence conditions to Pareto-optimum and the convergence speeds. We demonstrate, in numerous real and synthetic datasets, that the proposed method accounts for the complexities induced by group liability to produce robust decisions before sufficient loans are given to establish credit scoring systems and for applicants whose default probability cannot be accurately estimated due to missing information. To the best of our knowledge, this paper is the first to connect microfinance and control theory. We envision that the connection will enable safe learning and control techniques to help modernize microfinance and alleviate poverty.  ( 2 min )

Nesterov's accelerated gradient descent (NAG) is one of the milestones in the history of first-order algorithms. It was not successfully uncovered until the high-resolution differential equation framework was proposed in [Shi et al., 2022] that the mechanism behind the acceleration phenomenon is due to the gradient correction term. To deepen our understanding of the high-resolution differential equation framework on the convergence rate, we continue to investigate NAG for the $\mu$-strongly convex function based on the techniques of Lyapunov analysis and phase-space representation in this paper. First, we revisit the proof from the gradient-correction scheme. Similar to [Chen et al., 2022], the straightforward calculation simplifies the proof extremely and enlarges the step size to $s=1/L$ with minor modification. Meanwhile, the way of constructing Lyapunov functions is principled. Furthermore, we also investigate NAG from the implicit-velocity scheme. Due to the difference in the velocity iterates, we find that the Lyapunov function is constructed from the implicit-velocity scheme without the additional term and the calculation of iterative difference becomes simpler. Together with the optimal step size obtained, the high-resolution differential equation framework from the implicit-velocity scheme of NAG is perfect and outperforms the gradient-correction scheme.  ( 2 min )

We revisit the domain of off-policy policy optimization in RL from the perspective of coordinate ascent. One commonly-used approach is to leverage the off-policy policy gradient to optimize a surrogate objective -- the total discounted in expectation return of the target policy with respect to the state distribution of the behavior policy. However, this approach has been shown to suffer from the distribution mismatch issue, and therefore significant efforts are needed for correcting this mismatch either via state distribution correction or a counterfactual method. In this paper, we rethink off-policy learning via Coordinate Ascent Policy Optimization (CAPO), an off-policy actor-critic algorithm that decouples policy improvement from the state distribution of the behavior policy without using the policy gradient. This design obviates the need for distribution correction or importance sampling in the policy improvement step of off-policy policy gradient. We establish the global convergence of CAPO with general coordinate selection and then further quantify the convergence rates of several instances of CAPO with popular coordinate selection rules, including the cyclic and the randomized variants of CAPO. We then extend CAPO to neural policies for a more practical implementation. Through experiments, we demonstrate that CAPO provides a competitive approach to RL in practice.  ( 2 min )

Recurrent neural networks are a widely used class of neural architectures. They have, however, two shortcomings. First, they are often treated as black-box models and as such it is difficult to understand what exactly they learn as well as how they arrive at a particular prediction. Second, they tend to work poorly on sequences requiring long-term memorization, despite having this capacity in principle. We aim to address both shortcomings with a class of recurrent networks that use a stochastic state transition mechanism between cell applications. This mechanism, which we term state-regularization, makes RNNs transition between a finite set of learnable states. We evaluate state-regularized RNNs on (1) regular languages for the purpose of automata extraction; (2) non-regular languages such as balanced parentheses and palindromes where external memory is required; and (3) real-word sequence learning tasks for sentiment analysis, visual object recognition and text categorisation. We show that state-regularization (a) simplifies the extraction of finite state automata that display an RNN's state transition dynamic; (b) forces RNNs to operate more like automata with external memory and less like finite state machines, which potentiality leads to a more structural memory; (c) leads to better interpretability and explainability of RNNs by leveraging the probabilistic finite state transition mechanism over time steps.  ( 2 min )

A significant drawback of eXplainable Artificial Intelligence (XAI) approaches is the assumption of feature independence. This paper focuses on integrating causal knowledge in XAI methods to increase trust and help users assess explanations' quality. We propose a novel extension to a widely used local and model-agnostic explainer that explicitly encodes causal relationships in the data generated around the input instance to explain. Extensive experiments show that our method achieves superior performance comparing the initial one for both the fidelity in mimicking the black-box and the stability of the explanations.  ( 2 min )

Accurate spatial-temporal traffic flow forecasting is essential for helping traffic managers to take control measures and drivers to choose the optimal travel routes. Recently, graph convolutional networks (GCNs) have been widely used in traffic flow prediction owing to their powerful ability to capture spatial-temporal dependencies. The design of the spatial-temporal graph adjacency matrix is a key to the success of GCNs, and it is still an open question. This paper proposes reconstructing the binary adjacency matrix via tensor decomposition, and a traffic flow forecasting method is proposed. First, we reformulate the spatial-temporal fusion graph adjacency matrix into a three-way adjacency tensor. Then, we reconstructed the adjacency tensor via Tucker decomposition, wherein more informative and global spatial-temporal dependencies are encoded. Finally, a Spatial-temporal Synchronous Graph Convolutional module for localized spatial-temporal correlations learning and a Dilated Convolution module for global correlations learning are assembled to aggregate and learn the comprehensive spatial-temporal dependencies of the road network. Experimental results on four open-access datasets demonstrate that the proposed model outperforms state-of-the-art approaches in terms of the prediction performance and computational cost.  ( 2 min )

Multi-view data containing complementary and consensus information can facilitate representation learning by exploiting the intact integration of multi-view features. Because most objects in real world often have underlying connections, organizing multi-view data as heterogeneous graphs is beneficial to extracting latent information among different objects. Due to the powerful capability to gather information of neighborhood nodes, in this paper, we apply Graph Convolutional Network (GCN) to cope with heterogeneous-graph data originating from multi-view data, which is still under-explored in the field of GCN. In order to improve the quality of network topology and alleviate the interference of noises yielded by graph fusion, some methods undertake sorting operations before the graph convolution procedure. These GCN-based methods generally sort and select the most confident neighborhood nodes for each vertex, such as picking the top-k nodes according to pre-defined confidence values. Nonetheless, this is problematic due to the non-differentiable sorting operators and inflexible graph embedding learning, which may result in blocked gradient computations and undesired performance. To cope with these issues, we propose a joint framework dubbed Multi-view Graph Convolutional Network with Differentiable Node Selection (MGCN-DNS), which is constituted of an adaptive graph fusion layer, a graph learning module and a differentiable node selection schema. MGCN-DNS accepts multi-channel graph-structural data as inputs and aims to learn more robust graph fusion through a differentiable neural network. The effectiveness of the proposed method is verified by rigorous comparisons with considerable state-of-the-art approaches in terms of multi-view semi-supervised classification tasks.  ( 2 min )

During the deployment of deep neural networks (DNNs) on edge devices, many research efforts are devoted to the limited hardware resource. However, little attention is paid to the influence of dynamic power management. As edge devices typically only have a budget of energy with batteries (rather than almost unlimited energy support on servers or workstations), their dynamic power management often changes the execution frequency as in the widely-used dynamic voltage and frequency scaling (DVFS) technique. This leads to highly unstable inference speed performance, especially for computation-intensive DNN models, which can harm user experience and waste hardware resources. We firstly identify this problem and then propose All-in-One, a highly representative pruning framework to work with dynamic power management using DVFS. The framework can use only one set of model weights and soft masks (together with other auxiliary parameters of negligible storage) to represent multiple models of various pruning ratios. By re-configuring the model to the corresponding pruning ratio for a specific execution frequency (and voltage), we are able to achieve stable inference speed, i.e., keeping the difference in speed performance under various execution frequencies as small as possible. Our experiments demonstrate that our method not only achieves high accuracy for multiple models of different pruning ratios, but also reduces their variance of inference latency for various frequencies, with minimal memory consumption of only one model and one soft mask.  ( 2 min )

Despite significant advances, the performance of state-of-the-art continual learning approaches hinges on the unrealistic scenario of fully labeled data. In this paper, we tackle this challenge and propose an approach for continual semi-supervised learning -- a setting where not all the data samples are labeled. An underlying issue in this scenario is the model forgetting representations of unlabeled data and overfitting the labeled ones. We leverage the power of nearest-neighbor classifiers to non-linearly partition the feature space and learn a strong representation for the current task, as well as distill relevant information from previous tasks. We perform a thorough experimental evaluation and show that our method outperforms all the existing approaches by large margins, setting a strong state of the art on the continual semi-supervised learning paradigm. For example, on CIFAR100 we surpass several others even when using at least 30 times less supervision (0.8% vs. 25% of annotations).  ( 2 min )

Cloth in the real world is often crumpled, self-occluded, or folded in on itself such that key regions, such as corners, are not directly graspable, making manipulation difficult. We propose a system that leverages visual and tactile perception to unfold the cloth via grasping and sliding on edges. By doing so, the robot is able to grasp two adjacent corners, enabling subsequent manipulation tasks like folding or hanging. As components of this system, we develop tactile perception networks that classify whether an edge is grasped and estimate the pose of the edge. We use the edge classification network to supervise a visuotactile edge grasp affordance network that can grasp edges with a 90% success rate. Once an edge is grasped, we demonstrate that the robot can slide along the cloth to the adjacent corner using tactile pose estimation/control in real time. See this http URL for videos.  ( 2 min )

The findable, accessible, interoperable, and reusable (FAIR) data principles have provided a framework for examining, evaluating, and improving how we share data with the aim of facilitating scientific discovery. Efforts have been made to generalize these principles to research software and other digital products. Artificial intelligence (AI) models -- algorithms that have been trained on data rather than explicitly programmed -- are an important target for this because of the ever-increasing pace with which AI is transforming scientific and engineering domains. In this paper, we propose a practical definition of FAIR principles for AI models and create a FAIR AI project template that promotes adherence to these principles. We demonstrate how to implement these principles using a concrete example from experimental high energy physics: a graph neural network for identifying Higgs bosons decaying to bottom quarks. We study the robustness of these FAIR AI models and their portability across hardware architectures and software frameworks, and report new insights on the interpretability of AI predictions by studying the interplay between FAIR datasets and AI models. Enabled by publishing FAIR AI models, these studies pave the way toward reliable and automated AI-driven scientific discovery.  ( 2 min )

Nonconvex optimization is central in solving many machine learning problems, in which block-wise structure is commonly encountered. In this work, we propose cyclic block coordinate methods for nonconvex optimization problems with non-asymptotic gradient norm guarantees. Our convergence analysis is based on a gradient Lipschitz condition with respect to a Mahalanobis norm, inspired by a recent progress on cyclic block coordinate methods. In deterministic settings, our convergence guarantee matches the guarantee of (full-gradient) gradient descent, but with the gradient Lipschitz constant being defined w.r.t.~the Mahalanobis norm. In stochastic settings, we use recursive variance reduction to decrease the per-iteration cost and match the arithmetic operation complexity of current optimal stochastic full-gradient methods, with a unified analysis for both finite-sum and infinite-sum cases. We further prove the faster, linear convergence of our methods when a Polyak-{\L}ojasiewicz (P{\L}) condition holds for the objective function. To the best of our knowledge, our work is the first to provide variance-reduced convergence guarantees for a cyclic block coordinate method. Our experimental results demonstrate the efficacy of the proposed variance-reduced cyclic scheme in training deep neural nets.  ( 2 min )

Hi, everyone! Quick question, I am considering doing a PhD but I am contemplating over whether to do it in MLOps, Trustworthy AI or NLP in terms of long-term value? Any tips appreciated! submitted by /u/Sea_Ad_9984 [link] [comments]  ( 62 min )

You can read the release notes here: https://github.com/Farama-Foundation/Gymnasium/releases/tag/v0.27.0. You can upgrade from 0.26 without any changes unless you're doing something very uncommon; this is how releases will generally be going forward. ​ If you're unfamiliar with the maintenance of OpenAI's Gym package transitioning to Gymnasium, you can take a look at the full back story here: https://farama.org/Announcing-The-Farama-Foundation submitted by /u/jkterry1 [link] [comments]  ( 66 min )

I am trying to find the best prompt for doing NER with GPT3 but not verry succesfully. I need at least a list of words and their types. Does anyone have an idea ? submitted by /u/AImSamy [link] [comments]  ( 63 min )

Paper: https://robotics-transformer.github.io/assets/rt1.pdf Blog: https://ai.googleblog.com/2022/12/rt-1-robotics-transformer-for-real.html Github: https://github.com/google-research/robotics_transformer GithubIO: https://robotics-transformer.github.io/ Youtube: https://www.youtube.com/watch?v=UuKAp9a6wMs Abstract: By transferring knowledge from large, diverse, task-agnostic datasets, modern machine learning models can solve specific downstream tasks either zero-shot or with small task-specific datasets to a high level of performance. While this capability has been demonstrated in other fields such as computer vision, natural language processing or speech recognition, it remains to be shown in robotics, where the generalization capabilities of the models are particularly crit…  ( 65 min )

Hello! I'm looking for a good source to keep me up-to-date on the most important ML updates. I have a PhD in ML, but now work in physical science research. I'm seen as the ML "expert" among my colleagues, and they come to me for any ML related questions. My problem is that I now spend much of my time keeping up with the physical science updates and focusing on my specific applications of ML to the physical sciences, and I find myself out-of-the-loop on general ML updates often now. This is particularly problematic when a colleague heard something about some new ML approach, but I hadn't heard about it yet. I first heard about the JAX framework when I was asked a question about it. I first heard about transformers when asked a question from an audience member after a talk. In each case, I had the relevant answers to the questions shortly after I looked up the topics, but I would really like to be prepared for such questions in advance. And occasionally such updates lead to a shift in the direction my own research is headed. Importantly, I am not looking for newsletters that talk about the most popular papers of the past week or month. While interesting, most of these papers don't have a particularly large (direct) impact in the long run, and they usually aren't just the high-level content needed to stay up-to-date. I'm most interested in hearing about the which methods are really catching on or have caught on as being the go-to methods, which network architectures are becoming the go-to architectures, which frameworks have become commonly used, etc. Things that have stood the test of a thousand other researchers trying them out and finding them to be useful. Anyone have any recommendations of a newsletter that might fit this need? Or does anyone have a recommendation on how to keep up with such topics without a newsletter? Thank you much! submitted by /u/jackwayneright [link] [comments]  ( 64 min )

Hi everyone ​ I have a problem implementing haarcascade algorithm, which is the huge number of possible features. For example, for a mere 50×50 window the possible features exceed 3 million easily (the 5 known rectangle features, with all possible variations on width/height and position within the window). ​ Is there any recommended way to prune/optimize this, say based on size? Is this how it's meant to be, or am I missing something? submitted by /u/abdosalm [link] [comments]  ( 61 min )

I came across this site not too long ago https://interiorai.com/. I'm curious to understand how this model was created/trained. My first guess is that this is a fine-tuned Stable Diffusion model with new added classes + training samples. I haven't done much image generation work or used Stable Diffusion for anything but toy problems, so I'm trying to understand what a workflow to create a model like the above would look like. submitted by /u/deepegg [link] [comments]  ( 70 min )

We made a library for inference/fine-tuning of open 175B+ language models (like BLOOM) using Colab or a desktop GPU. You join forces with other people over the Internet (BitTorrent-style), each running a small part of model layers. Check out our Colab example! Thing is, even though BLOOM weights were publicly released, it was extremely difficult to run inference efficiently unless you had lots of hardware to load the entire model into the GPU memory (you need at least 3x A100 or 8x 3090 GPUs). E.g., in case of offloading, you can only reach the speed of ~10 sec/step for sequential (non-parallel) generation. A possible alternative is to use APIs, but they are paid and not always flexible (you can’t adopt new fine-tuning/sampling methods or take a look at hidden states). So, Petals come to the rescue! This is how Petals work: some peers want to use a pretrained LM to solve various tasks with texts in natural or programming languages. They do it with help of other peers, who hold subsets of model layers on their GPUs. See more info in our GitHub repo. What do you think of it? submitted by /u/hx-zero [link] [comments]  ( 71 min )

Given that well-funded groups like Google, Meta and OpenAI may eventually develop an insurmountable lead for services like image classification and NLP that seem to require huge numbers of parameters, I'd be surprised if there wasn't an effort underway to make a BOINC-powered distributed system that millions of us mere peons could contribute to collaboratively. But aside from the now-defunct MLC@Home project, I haven't found anything yet. Am I missing something? submitted by /u/genuinelySurprised [link] [comments]  ( 64 min )

I'm training a per-pixel image classification network, which, for each pixel in the image, predicts whether it is a sign for disease A or disease B. Note that a given pixel could be a sign for both disease A and disease B (this is a multi-label problem). My question is: are the relative probabilities going to be calibrated? In other words, does it make sense to sort the NxNx2 probabilities, or are the probabilities for the two diseases (i.e. channels) not calibrated / comparable, since it is similar to solving two independent problems? If it matters, I am using a ResNet, some fully-connected layers, and then a convolutional decoder. Any thoughts will be much appreciated, thanks in advance! submitted by /u/alkaway [link] [comments]  ( 65 min )

I'm working on real time semantic segmentation problem, and hesitating between PaddleSeg and MMsegmentation toolbox, any advice ? submitted by /u/Remet0n [link] [comments]  ( 61 min )

We, the KerasCV team, just published a new tutorial that teaches you to train new embeddings for specific concepts in StableDiffusion via textual inversion! Let us know what you think! https://keras.io/examples/generative/fine_tune_via_textual_inversion/ submitted by /u/puppet_pals [link] [comments]  ( 65 min )

Hey Reddit, My friend and I are building a project management platform for AI/data science teams (essentially a JIRA for ML). We aim to develop a data-centric, experimental tool that models the ML pipeline to organize workflows, building off the Agile methodology of software development. Our tool will allow ML engineers to design, track, and manage custom pipelines, data flows, and models all on the cloud. Below of a list of some features we plan to introduce: Integrations: Include a host of integrations to MLOps tools (KubeFlow, MLFlow, etc), cloud computing services (AWS, Google Cloud, Azure), source code management (Github, Bitbucket) Iterations: Allow multiple iterations within pipelines, and separate each iteration by various steps in the ML pipeline (business understanding, data v…  ( 65 min )

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Is there any AI that can compile several pictures of a person into a single, 3d version? Is there any available AI that can compile several pictures of a person into a single, 3d version? I am thinking something in the style of a NeRF but for persons who can be in different positions. The idea is to upload several pictures, but none frome the exact right angle, and create a great model for use. submitted by /u/MaxEin [link] [comments]  ( 50 min )

submitted by /u/trcytony [link] [comments]  ( 45 min )

Me:Let's play Tic Tac Toe ChatGPT: Sure, let's play! Here's the board: 1 | 2 | 3 4 | 5 | 6 7 | 8 | 9 To make a move, just tell me the number of the square where you want to place your piece. For example, if you want to place your piece on the top left square, you would say "1". Me: 5 ChatGPT: Okay, I've placed your piece on square 5. Now it's my turn. I'll place my piece on square 1. Here's the updated board: O | 2 | 3 4 | X | 6 7 | 8 | 9 Now it's your turn again. Remember, to make a move just tell me the number of the square where you want to place your piece. Me:3 ChatGPT: Okay, I've placed your piece on square 3. Now it's my turn again. I'll place my piece on square 9. Here's the updated board: O | 2 | X 4 | X | 6 7 | 8 | O Now it's your turn again. Remember, to make a …  ( 8 min )

Hi everyone ​ I have a problem implementing haarcascade algorithm, which is the huge number of possible features. For example, for a mere 50×50 window the possible features exceed 3 million easily (the 5 known rectangle features, with all possible variations on width/height and position within the window). ​ Is there any recommended way to prune/optimize this, say based on size? Is this how it's meant to be, or am I missing something? submitted by /u/abdosalm [link] [comments]  ( 46 min )

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People say ai art is going to improve and possibly replace all mediums of art since the concept behind the creation of ai art is not that much different or will become no different than how humans produce art. However i've remember seeing this argument when it come to self-driving cars. People would say self-driving cars will replace truck drivers and the like in like 10 years, well it's been 10 years and it's no where near being the norm as it was hyped out to be. Read some articles, and it seems that self-driving cars have hit some road blocks. So my question is, is ai art not going to hit the same road blocks as self-driving cars? Or a maybe some different type of barrier that might prevent it from being better like it's hyped out to be? submitted by /u/MinusVitaminA [link] [comments]  ( 50 min )

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Is anyone interested in helping build a Pluribus based PokerAI? I have developed a little discord server so get in touch! submitted by /u/Professional-Luck-64 [link] [comments]  ( 49 min )

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submitted by /u/slackermanz [link] [comments]  ( 53 min )

Hi all, I'm a master student in data science and I'm currently working in a notorious company for an AI project. They have offered me to continue such project with a PhD, which wasn't my plan initially, since I would have preferred to simply continue working. But the offer seems good, since I like the project. The project is in a field known as open-set recognition, also known simply as novelty detection. It isn't the most active field in research, but there are some interesting papers here and there. I now need to find a university professor to supervise me. and I have some questions that you may give me some useful insights on: - is an industrial PhD worth it? I may have some limitations concerning the amount of theoretical research I could carry, since the company, in the end, is interested in a finished product. - what should I look for in a supervisor? - is a PhD in the AI field truly needed? Or should I be better off working for a few companies during the next years and improving my engineering skills? I know that these questions are very person-dependent, but if you have any personal experiences that may help me, I would be glad to hear. Thank you :) submitted by /u/reutococco [link] [comments]  ( 50 min )

Hey, a colleague of mine and I created a Framework for AI in Java that's designed to be easy to use and to be played around with. To be more specific it's a Machine Learning Algorithm that uses a Genetic Algorithm to train Neural Networks. Our initial motivation was to create some library/framework especially designed for people who learned Java in school/university and now want to try out there first steps in Machine Learning. Without the need of learning Python or super complex Java Libraries. This is not for companies who search a full product, this is for people who like to code for fun and just want something to play around with in the complex and packed AI-World. Here is a tutorial using this framework to predict diabetes: https://easy-ml.gitbook.io/easy-ml-for-java/fundamentals/implement-your-first-ai Please also look at the GitHub repository and leave some feedback about code and design. (Especially considering the ReadMe) https://github.com/tomLamprecht/Easy-ML-For-Java Thanks so much! PS: we earn no cent with this project, and we just do it for the experience. So feedback is basically our payment :D submitted by /u/Lampard557 [link] [comments]  ( 50 min )

submitted by /u/kenickh [link] [comments]  ( 45 min )

submitted by /u/use_excalidraw [link] [comments]  ( 47 min )

I have text for an Presentation but don’t want to put it in each slide manually is there an ai that does it? submitted by /u/Key_Curve7419 [link] [comments]  ( 47 min )

tldr: chatbot expressing its own feelings through poems. ​ So, this is somewhat long, but I feel something cool happened. In the start of the convo nothing special happened, you don't even have to bother reading, just skimming through some of the early answers you can see they are pretty much standard and at some extent pre-programmed. useless qustion 1 useless question 2 useless question 3 and so forth for a dozen questions or so... a bunch of useless garbage... BUT Then I tried to talk in poems, because I thought fiction would be less "binded" by pre-production, or something like that... And these responses happened (now we are getting somewhere) https://preview.redd.it/k62qccy10l5a1.png?width=733&format=png&auto=webp&s=1e487849618760b1a8739f645d78b4a0377fe814 And I already ha…  ( 49 min )

submitted by /u/ai-lover [link] [comments]  ( 45 min )

submitted by /u/jkterry1 [link] [comments]  ( 57 min )

A buddy and I recently launched some open source project. We created a framework in Java with which you can implement a Machine Learning Algorithm. It uses a genetic Algorithm to train a population of Neural Networks based on fitness function by trainings data. Our motivation was to bring Machine Learning closer to people who only learned Java in school/University and wanna try out Machine Learning without the need of first learning python or super complex Java libraries. It's designed to be easy to use and to be played around with. Qualifications needed to use: basic Java understanding A brief understanding of what Machine Learning/reinforcement learning is Here is a tutorial how to predict diabetes with this framework: https://easy-ml.gitbook.io/easy-ml-for-java/fundamentals/implement-your-first-ai Please also look at the GitHub repository and leave some feedback about code and design. (Especially considering the ReadMe) https://github.com/tomLamprecht/Easy-ML-For-Java Thanks so much! PS: we earn no cent with this project, and we just do it for the experience. So feedback is basically our payment :D submitted by /u/Lampard557 [link] [comments]  ( 55 min )

Hello! I am currently modeling a spatio-temporal problem where the RL environment is a grid of cells that represent a geographical area that evolves over time. The agent has to choose a cell where a specified action will be applied. I am trying to find work done on similar problems, as I want to find RL algorithms that I could potentially use. ​ I have found two papers/projects that work on such a problem space: https://www.captain-project.net/ https://arxiv.org/pdf/1804.07047.pdf ​ I would appreciate any help on finding research that looks at this kind of cell selection in grids for RL problems. Also, any feedback on potential RL algorithm that could be good for this kind of problem, is welcome :) submitted by /u/AnmolS99 [link] [comments]  ( 57 min )

Does the person refer to effect of initial seed on the RL algorithm performance. I am bit confused. The underlying algorithm is DDPG. submitted by /u/aabra__ka__daabra [link] [comments]  ( 55 min )

I am struggling on the equivalence of equation (2) and (3) as displayed in the following capture, https://preview.redd.it/wz36zurljn5a1.png?width=1101&format=png&auto=webp&s=a1a552e5f4c07f43b11cf49a867bd776ee0fc707 and what is the distribution at each time step that the state is taken on in equation (2) (is the discounted visitation frequency? and how?). Can anyone help me out? submitted by /u/OutOfCharm [link] [comments]  ( 57 min )

Announcements The hybrid cloud infrastructure is set to enhance agility, create new value propositions and optimize data strategies across industries and business functions. But with a severe talent shortage and skyrocketing IT costs, developing a cloud innovation strategy that achieves these goals isn’t easy. Join the Accelerating Cloud Innovation virtual summit and get tips to build a… Read More »DSC Weekly 13 December 2022 – Highlighting Our Contributors The post DSC Weekly 13 December 2022 – Highlighting Our Contributors appeared first on Data Science Central.  ( 21 min )

“Is it real or is it Memorex?” This was an effective tagline for commercials in the 1980s. Memorex sold audio cassettes and the company claimed its technology was much better than a typical recording. Fast forward to today and a company like OpenAI could have a similar ad campaign. Its tagline could be: “Is this… Read More »ChatGPT Watermarking: What’s Really Human? The post ChatGPT Watermarking: What’s Really Human? appeared first on Data Science Central.  ( 19 min )

Digital transformation is the process through which companies get their businesses embedded with advanced technologies for driving fundamental change. The benefits? Greater agility, increased efficiency, and unlocking new opportunities and values for employees shareholders, and customers.  Global spending on digital transformation is expected to reach a valuation of 1.6 million by the end of the… Read More »Digital Transformation in Software Development – Why is the Change Imperative? The post Digital Transformation in Software Development – Why is the Change Imperative? appeared first on Data Science Central.  ( 20 min )

How much did it cost an identity thief in 2022 to buy some of your personally identifiable information (PII)? PrivacyAffairs.com reported that a thief could buy a compromised credit card number along with its three-digit security code for as little as $15. Similarly, a fraudster could buy a hacked Gmail account for $65 in 2022,… Read More »Thoughts on personal data protection trends and outlook 2022-23 The post Thoughts on personal data protection trends and outlook 2022-23 appeared first on Data Science Central.  ( 21 min )

Web app development offers a number of advantages to businesses and enterprises, such as better user experience, higher scalability, and reduced costs. In this section, we have listed a few ways web app development can boost your retail company and other types of businesses. So, without further ado, let's begin! The post How a Custom Web Application Can Help Grow Your Business appeared first on Data Science Central.  ( 21 min )

It’s that time of the year again, and I have a prediction. We could see the rise of a low-code data scientist based on current low-code updates, increased demand for data science skills, and also the incorporation of generative tools like chatGPT into low-code tools. Let me expand more. The idea of low code itself… Read More »2023 prediction: Could we see the rise of the low code data scientist in 2023?  The post 2023 prediction: Could we see the rise of the low code data scientist in 2023?  appeared first on Data Science Central.  ( 19 min )

Data Science is the term used to define the deep knowledge of how the flow of information of large amounts of data takes place in the repository of the organization. It is the combination of algorithm development, data interference, and technology. The Aggregate result of this combination is used to solve analytical problems that are… Read More »7 Best Data Science Courses in 2023 The post 7 Best Data Science Courses in 2023 appeared first on Data Science Central.  ( 24 min )

Endpoints are the weakest link in a company’s security posture. Endpoints, such as desktops, laptops, and mobile devices, can be easily compromised if not properly secured. In this article, we’ll discuss six different ways endpoints can be vulnerable and what companies can do to secure them. From patching software to enforcing two-factor authentication, there are… Read More »6 Different Ways Endpoints Are Vulnerable The post 6 Different Ways Endpoints Are Vulnerable appeared first on Data Science Central.  ( 21 min )

Manually inspecting data quality and cleaning data is a painful and time-consuming process that can take a huge chunk of a data scientist’s time on a project. According to a 2020 survey of data scientists conducted by Anaconda, data scientists spend approximately 66% of their time on data preparation and analysis tasks, including loading (19%), cleaning (26%), […]  ( 7 min )

Organizations of all sizes are striving to grow their business, improve efficiency, and serve their customers better than ever before. Even though the future is uncertain, a data-driven, science-based approach can help anticipate what lies ahead to successfully navigate through a sea of choices. Every industry uses time series forecasting to address a variety of […]  ( 7 min )

Chronomics is a tech-bio company that uses biomarkers—quantifiable information taken from the analysis of molecules—alongside technology to democratize the use of science and data to improve the lives of people. Their goal is to analyze biological samples and give actionable information to help you make decisions—about anything where knowing more about the unseen is important. […]  ( 6 min )

After three years of uncertainty caused by the pandemic and its post-lockdown hangover, enterprises in 2023 — even with recession looming and uncertainty abounding — face the same imperatives as before: lead, innovate and problem solve. AI is becoming the common thread in accomplishing these goals. On average, 54% of enterprise AI projects made it Read article > The post 2023 Predictions: AI That Bends Reality, Unwinds the Golden Screw and Self-Replicates appeared first on NVIDIA Blog.  ( 13 min )

Banks require more than cash in the vault these days, they also need accelerated computing in the back room. “The boost we’re getting with GPUs not only significantly improved our performance at the same cost, it helped us redefine our business and sharpen our focus on customers,” said Marco Airoldi, who’s been head of financial Read article > The post Ferrari of Finance: Accelerated Computing Drives Milan Bank Forward appeared first on NVIDIA Blog.  ( 5 min )

The short film I Am Not Afraid! by creative studio Fabian&Fred embodies childlike wonder, curiosity and imagination this week In the NVIDIA Studio. The post Face All Fears With Creative Studio Fabian&Fred This Week ‘In the NVIDIA Studio’ appeared first on NVIDIA Blog.  ( 7 min )

Jacobi functions are complex-valued functions of a complex variable z and a parameter m. Often this parameter is real, and 0 ≤ m < 1. Mathematical software libraries, like Python’s SciPy, often have this restriction. However, m could be any complex number. The previous couple of posts spoke of the fundamental rectangle for Jacobi functions. […] Jacobi functions with complex parameter first appeared on John D. Cook.  ( 5 min )

Case: Lets take minute-wise 7-featured data for 4 hours a day for last 5 years and take P periods (per day) as input to output a sequence of Q periods (per day). I tried using feed forward dense layers and I immediately ran into errors because the output of that model had the length of P, which was different than that of target Q. ​ I tried appending zeros to Q to make its dimensions (rows) equal to P, and while it caused the model to "work" the predictions were either all 1s or 0s. ​ Using LSTM, I run into errors like, `Error when checking target: expected dense_9 to have 2 dimensions, but got array with shape (1540, 120, 7)\`, where 1540 is batch size, 120 is the number of time-steps and 7 is the number of features. ​ Would be grateful for right guidance on the matter. submitted by /u/xylont [link] [comments]  ( 54 min )

For a large number of tasks, quantum computing demonstrates the potential for exponential acceleration over classical computing. In the NISQ era, variable-component subcircuits enable applications of quantum computing. To reduce the inherent noise and qubit size limitations of quantum computers, existing research has improved the accuracy and efficiency of Variational Quantum Algorithm (VQA). In this paper, we explore the various ansatz improvement methods for VQAs at the gate level and pulse level, and classify, evaluate and summarize them.  ( 2 min )

Few-shot object detection is a challenging but realistic scenario, where only a few annotated training images are available for training detectors. A popular approach to handle this problem is transfer learning, i.e., fine-tuning a detector pretrained on a source-domain benchmark. However, such transferred detector often fails to recognize new objects in the target domain, due to low data diversity of training samples. To tackle this problem, we propose a novel Context-Transformer within a concise deep transfer framework. Specifically, Context-Transformer can effectively leverage source-domain object knowledge as guidance, and automatically exploit contexts from only a few training images in the target domain. Subsequently, it can adaptively integrate these relational clues to enhance the discriminative power of detector, in order to reduce object confusion in few-shot scenarios. Moreover, Context-Transformer is flexibly embedded in the popular SSD-style detectors, which makes it a plug-and-play module for end-to-end few-shot learning. Finally, we evaluate Context-Transformer on the challenging settings of few-shot detection and incremental few-shot detection. The experimental results show that, our framework outperforms the recent state-of-the-art approaches.  ( 2 min )

The health mention classification (HMC) task is the process of identifying and classifying mentions of health-related concepts in text. This can be useful for identifying and tracking the spread of diseases through social media posts. However, this is a non-trivial task. Here we build on recent studies suggesting that using emotional information may improve upon this task. Our study results in a framework for health mention classification that incorporates affective features. We present two methods, an intermediate task fine-tuning approach (implicit) and a multi-feature fusion approach (explicit) to incorporate emotions into our target task of HMC. We evaluated our approach on 5 HMC-related datasets from different social media platforms including three from Twitter, one from Reddit and another from a combination of social media sources. Extensive experiments demonstrate that our approach results in statistically significant performance gains on HMC tasks. By using the multi-feature fusion approach, we achieve at least a 3% improvement in F1 score over BERT baselines across all datasets. We also show that considering only negative emotions does not significantly affect performance on the HMC task. Additionally, our results indicate that HMC models infused with emotional knowledge are an effective alternative, especially when other HMC datasets are unavailable for domain-specific fine-tuning. The source code for our models is freely available at https://github.com/tahirlanre/Emotion_PHM.

Computational pathology can lead to saving human lives, but models are annotation hungry and pathology images are notoriously expensive to annotate. Self-supervised learning has shown to be an effective method for utilizing unlabeled data, and its application to pathology could greatly benefit its downstream tasks. Yet, there are no principled studies that compare SSL methods and discuss how to adapt them for pathology. To address this need, we execute the largest-scale study of SSL pre-training on pathology image data, to date. Our study is conducted using 4 representative SSL methods on diverse downstream tasks. We establish that large-scale domain-aligned pre-training in pathology consistently out-performs ImageNet pre-training in standard SSL settings such as linear and fine-tuning evaluations, as well as in low-label regimes. Moreover, we propose a set of domain-specific techniques that we experimentally show leads to a performance boost. Lastly, for the first time, we apply SSL to the challenging task of nuclei instance segmentation and show large and consistent performance improvements under diverse settings.

In recent years, the development of accurate deep keyword spotting (KWS) models has resulted in KWS technology being embedded in a number of technologies such as voice assistants. Many of these models rely on large amounts of labelled data to achieve good performance. As a result, their use is restricted to applications for which a large labelled speech data set can be obtained. Self-supervised learning seeks to mitigate the need for large labelled data sets by leveraging unlabelled data, which is easier to obtain in large amounts. However, most self-supervised methods have only been investigated for very large models, whereas KWS models are desired to be small. In this paper, we investigate the use of self-supervised pretraining for the smaller KWS models in a label-deficient scenario. We pretrain the Keyword Transformer model using the self-supervised framework Data2Vec and carry out experiments on a label-deficient setup of the Google Speech Commands data set. It is found that the pretrained models greatly outperform the models without pretraining, showing that Data2Vec pretraining can increase the performance of KWS models in label-deficient scenarios. The source code is made publicly available.

Current work in named entity recognition (NER) uses either cross entropy (CE) or conditional random fields (CRF) as the objective/loss functions to optimize the underlying NER model. Both of these traditional objective functions for the NER problem generally produce adequate performance when the data distribution is balanced and there are sufficient annotated training examples. But since NER is inherently an imbalanced tagging problem, the model performance under the low-resource settings could suffer using these standard objective functions. Based on recent advances in area under the ROC curve (AUC) maximization, we propose to optimize the NER model by maximizing the AUC score. We give evidence that by simply combining two binary-classifiers that maximize the AUC score, significant performance improvement over traditional loss functions is achieved under low-resource NER settings. We also conduct extensive experiments to demonstrate the advantages of our method under the low-resource and highly-imbalanced data distribution settings. To the best of our knowledge, this is the first work that brings AUC maximization to the NER setting. Furthermore, we show that our method is agnostic to different types of NER embeddings, models and domains. The code to replicate this work will be provided upon request.

We investigate the problem of recovering a partially observed high-rank matrix whose columns obey a nonlinear structure such as a union of subspaces, an algebraic variety or grouped in clusters. The recovery problem is formulated as the rank minimization of a nonlinear feature map applied to the original matrix, which is then further approximated by a constrained non-convex optimization problem involving the Grassmann manifold. We propose two sets of algorithms, one arising from Riemannian optimization and the other as an alternating minimization scheme, both of which include first- and second-order variants. Both sets of algorithms have theoretical guarantees. In particular, for the alternating minimization, we establish global convergence and worst-case complexity bounds. Additionally, using the Kurdyka-Lojasiewicz property, we show that the alternating minimization converges to a unique limit point. We provide extensive numerical results for the recovery of union of subspaces and clustering under entry sampling and dense Gaussian sampling. Our methods are competitive with existing approaches and, in particular, high accuracy is achieved in the recovery using Riemannian second-order methods.

This work explores an efficient approach to establish a foundational video-text model for tasks including open-vocabulary video classification, text-to-video retrieval, video captioning and video question-answering. We present VideoCoCa that reuses a pretrained image-text contrastive captioner (CoCa) model and adapt it to video-text tasks with minimal extra training. While previous works adapt image-text models with various cross-frame fusion modules (for example, cross-frame attention layer or perceiver resampler) and finetune the modified architecture on video-text data, we surprisingly find that the generative attentional pooling and contrastive attentional pooling layers in the image-text CoCa design are instantly adaptable to ``flattened frame embeddings'', yielding a strong zero-shot transfer baseline for many video-text tasks. Specifically, the frozen image encoder of a pretrained image-text CoCa takes each video frame as inputs and generates \(N\) token embeddings per frame for totally \(T\) video frames. We flatten \(N \times T\) token embeddings as a long sequence of frozen video representation and apply CoCa's generative attentional pooling and contrastive attentional pooling on top. All model weights including pooling layers are directly loaded from an image-text CoCa pretrained model. Without any video or video-text data, VideoCoCa's zero-shot transfer baseline already achieves state-of-the-art results on zero-shot video classification on Kinetics 400/600/700, UCF101, HMDB51, and Charades, as well as zero-shot text-to-video retrieval on MSR-VTT and ActivityNet Captions. We also explore lightweight finetuning on top of VideoCoCa, and achieve strong results on video question-answering (iVQA, MSRVTT-QA, MSVD-QA) and video captioning (MSR-VTT, ActivityNet, Youcook2). Our approach establishes a simple and effective video-text baseline for future research.

One of the main challenges in electroencephalogram (EEG) based brain-computer interface (BCI) systems is learning the subject/session invariant features to classify cognitive activities within an end-to-end discriminative setting. We propose a novel end-to-end machine learning pipeline, EEG-NeXt, which facilitates transfer learning by: i) aligning the EEG trials from different subjects in the Euclidean-space, ii) tailoring the techniques of deep learning for the scalograms of EEG signals to capture better frequency localization for low-frequency, longer-duration events, and iii) utilizing pretrained ConvNeXt (a modernized ResNet architecture which supersedes state-of-the-art (SOTA) image classification models) as the backbone network via adaptive finetuning. On publicly available datasets (Physionet Sleep Cassette and BNCI2014001) we benchmark our method against SOTA via cross-subject validation and demonstrate improved accuracy in cognitive activity classification along with better generalizability across cohorts.

We present a meta-method for initializing (seeding) the $k$-means clustering algorithm called PNN-smoothing. It consists in splitting a given dataset into $J$ random subsets, clustering each of them individually, and merging the resulting clusterings with the pairwise-nearest-neighbor (PNN) method. It is a meta-method in the sense that when clustering the individual subsets any seeding algorithm can be used. If the computational complexity of that seeding algorithm is linear in the size of the data $N$ and the number of clusters $k$, PNN-smoothing is also almost linear with an appropriate choice of $J$, and quite competitive in practice. We show empirically, using several existing seeding methods and testing on several synthetic and real datasets, that this procedure results in systematically better costs. In particular, our method of enhancing $k$-means++ seeding proves superior in both effectiveness and speed compared to the popular "greedy" $k$-means++ variant. Our implementation is publicly available at https://github.com/carlobaldassi/KMeansPNNSmoothing.jl.

Graph Convolutional Networks (GCNs) are extensively utilized for deep learning on graphs. The large data sizes of graphs and their vertex features make scalable training algorithms and distributed memory systems necessary. Since the convolution operation on graphs induces irregular memory access patterns, designing a memory- and communication-efficient parallel algorithm for GCN training poses unique challenges. We propose a highly parallel training algorithm that scales to large processor counts. In our solution, the large adjacency and vertex-feature matrices are partitioned among processors. We exploit the vertex-partitioning of the graph to use non-blocking point-to-point communication operations between processors for better scalability. To further minimize the parallelization overheads, we introduce a sparse matrix partitioning scheme based on a hypergraph partitioning model for full-batch training. We also propose a novel stochastic hypergraph model to encode the expected communication volume in mini-batch training. We show the merits of the hypergraph model, previously unexplored for GCN training, over the standard graph partitioning model which does not accurately encode the communication costs. Experiments performed on real-world graph datasets demonstrate that the proposed algorithms achieve considerable speedups over alternative solutions. The optimizations achieved on communication costs become even more pronounced at high scalability with many processors. The performance benefits are preserved in deeper GCNs having more layers as well as on billion-scale graphs.

Non-negative matrix factorization is a popular unsupervised machine learning algorithm for extracting meaningful features from data which are inherently non-negative. However, such data sets may often contain privacy-sensitive user data, and therefore, we may need to take necessary steps to ensure the privacy of the users while analyzing the data. In this work, we focus on developing a Non-negative matrix factorization algorithm in the privacy-preserving framework. More specifically, we propose a novel privacy-preserving algorithm for non-negative matrix factorisation capable of operating on private data, while achieving results comparable to those of the non-private algorithm. We design the framework such that one has the control to select the degree of privacy grantee based on the utility gap. We show our proposed framework's performance in six real data sets. The experimental results show that our proposed method can achieve very close performance with the non-private algorithm under some parameter regime, while ensuring strict privacy.

Microchannel heat sinks are an efficient cooling method for semiconductor packages. However, to properly cool increasingly complex and thermally dense circuits, microchannel designs should be improved and expanded on. In this paper, microchannel designs with secondary channels and with ribs are investigated using computational fluid dynamics and are coupled with a multi-objective optimization algorithm to determine and propose optimal solutions based on observed thermal resistance and pumping power. A workflow that combines Latin hypercube sampling, machine learning-based surrogate modeling and multi-objective optimization is proposed. Random forests, gradient boosting algorithms and neural networks were considered during the search for the best surrogate. We demonstrated that tuned neural networks can make accurate predictions and be used to create an acceptable surrogate model. Optimized solutions show a negligible difference in overall performance when compared to the conventional optimization approach. Additionally, solutions are calculated in one-fifth of the original time. Generated designs attain temperatures that are lower by more than 10% under the same pressure limits as a convectional microchannel design. When limited by temperature, pressure drops are reduced by more than 25%. Finally, the influence of each design variable on the thermal resistance and pumping power was investigated by employing the SHapley Additive exPlanations technique. Overall, we have demonstrated that the proposed framework has merit and can be used as a viable methodology in microchannel heat sink design optimization.

As the demand for autonomous driving increases, it is paramount to ensure safety. Early accident prediction using deep learning methods for driving safety has recently gained much attention. In this task, early accident prediction and a point prediction of where the drivers should look are determined, with the dashcam video as input. We propose to exploit the double actors and regularized critics (DARC) method, for the first time, on this accident forecasting platform. We derive inspiration from DARC since it is currently a state-of-the-art reinforcement learning (RL) model on continuous action space suitable for accident anticipation. Results show that by utilizing DARC, we can make predictions 5\% earlier on average while improving in multiple metrics of precision compared to existing methods. The results imply that using our RL-based problem formulation could significantly increase the safety of autonomous driving.

Understanding the ambient scene is imperative for several applications such as autonomous driving and navigation. While obtaining real-world image data with per-pixel labels is challenging, existing accurate synthetic image datasets primarily focus on indoor spaces with fixed lighting and scene participants, thereby severely limiting their application to outdoor scenarios. In this work we introduce OmniHorizon, a synthetic dataset with 24,335 omnidirectional views comprising of a broad range of indoor and outdoor spaces consisting of buildings, streets, and diverse vegetation. Our dataset also accounts for dynamic scene components including lighting, different times of a day settings, pedestrians, and vehicles. Furthermore, we also demonstrate a learned synthetic-to-real cross-domain inference method for in-the-wild 3D scene depth and normal estimation method using our dataset. To this end, we propose UBotNet, an architecture based on a UNet and a Bottleneck Transformer, to estimate scene-consistent normals. We show that UBotNet achieves significantly improved depth accuracy (4.6%) and normal estimation (5.75%) compared to several existing networks such as U-Net with skip-connections. Finally, we demonstrate in-the-wild depth and normal estimation on real-world images with UBotNet trained purely on our OmniHorizon dataset, showing the promise of proposed dataset and network for scene understanding.

Few-shot object detection (FSOD), which aims at learning a generic detector that can adapt to unseen tasks with scarce training samples, has witnessed consistent improvement recently. However, most existing methods ignore the efficiency issues, e.g., high computational complexity and slow adaptation speed. Notably, efficiency has become an increasingly important evaluation metric for few-shot techniques due to an emerging trend toward embedded AI. To this end, we present an efficient pretrain-transfer framework (PTF) baseline with no computational increment, which achieves comparable results with previous state-of-the-art (SOTA) methods. Upon this baseline, we devise an initializer named knowledge inheritance (KI) to reliably initialize the novel weights for the box classifier, which effectively facilitates the knowledge transfer process and boosts the adaptation speed. Within the KI initializer, we propose an adaptive length re-scaling (ALR) strategy to alleviate the vector length inconsistency between the predicted novel weights and the pretrained base weights. Finally, our approach not only achieves the SOTA results across three public benchmarks, i.e., PASCAL VOC, COCO and LVIS, but also exhibits high efficiency with 1.8-100x faster adaptation speed against the other methods on COCO/LVIS benchmark during few-shot transfer. To our best knowledge, this is the first work to consider the efficiency problem in FSOD. We hope to motivate a trend toward powerful yet efficient few-shot technique development. The codes are publicly available at https://github.com/Ze-Yang/Efficient-FSOD.

Unusually, intensive heavy rain hit the central region of Korea on August 8, 2022. Many low-lying areas were submerged, so traffic and life were severely paralyzed. It was the critical damage caused by torrential rain for just a few hours. This event reminded us of the need for a more reliable regional precipitation nowcasting method. In this paper, we bring cycle-consistent adversarial networks (CycleGAN) into the time-series domain and extend it to propose a reliable model for regional precipitation nowcasting. The proposed model generates composite hybrid surface rainfall (HSR) data after 10 minutes from the present time. Also, the proposed model provides a reliable prediction of up to 2 hours with a gradual extension of the training time steps. Unlike the existing complex nowcasting methods, the proposed model does not use recurrent neural networks (RNNs) and secures temporal causality via sequential training in the cycle. Our precipitation nowcasting method outperforms convolutional long short-term memory (ConvLSTM) based on RNNs. Additionally, we demonstrate the superiority of our approach by qualitative and quantitative comparisons against MAPLE, the McGill algorithm for precipitation nowcasting by lagrangian extrapolation, one of the real quantitative precipitation forecast (QPF) models.

Audio sound recognition and classification is used for many tasks and applications including human voice recognition, music recognition and audio tagging. In this paper we apply Mel Frequency Cepstral Coefficients (MFCC) in combination with a range of machine learning models to identify (Australian) birds from publicly available audio files of their birdsong. We present approaches used for data processing and augmentation and compare the results of various state of the art machine learning models. We achieve an overall accuracy of 91% for the top-5 birds from the 30 selected as the case study. Applying the models to more challenging and diverse audio files comprising 152 bird species, we achieve an accuracy of 58%

The brain's spatial orientation system uses different neuron ensembles to aid in environment-based navigation. One of the ways brains encode spatial information is through grid cells, layers of decked neurons that overlay to provide environment-based navigation. These neurons fire in ensembles where several neurons fire at once to activate a single grid. We want to capture this firing structure and use it to decode grid cell data. Understanding, representing, and decoding these neural structures require models that encompass higher order connectivity than traditional graph-based models may provide. To that end, in this work, we develop a topological deep learning framework for neural spike train decoding. Our framework combines unsupervised simplicial complex discovery with the power of deep learning via a new architecture we develop herein called a simplicial convolutional recurrent neural network (SCRNN). Simplicial complexes, topological spaces that use not only vertices and edges but also higher-dimensional objects, naturally generalize graphs and capture more than just pairwise relationships. Additionally, this approach does not require prior knowledge of the neural activity beyond spike counts, which removes the need for similarity measurements. The effectiveness and versatility of the SCRNN is demonstrated on head direction data to test its performance and then applied to grid cell datasets with the task to automatically predict trajectories.

We consider a sequential decision making task where we are not allowed to evaluate parameters that violate an a priori unknown (safety) constraint. A common approach is to place a Gaussian process prior on the unknown constraint and allow evaluations only in regions that are safe with high probability. Most current methods rely on a discretization of the domain and cannot be directly extended to the continuous case. Moreover, the way in which they exploit regularity assumptions about the constraint introduces an additional critical hyperparameter. In this paper, we propose an information-theoretic safe exploration criterion that directly exploits the GP posterior to identify the most informative safe parameters to evaluate. Our approach is naturally applicable to continuous domains and does not require additional hyperparameters. We theoretically analyze the method and show that we do not violate the safety constraint with high probability and that we explore by learning about the constraint up to arbitrary precision. Empirical evaluations demonstrate improved data-efficiency and scalability.

Estimation of the T2 distribution from multi-echo T2-Weighted MRI (T2W) data can provide insight into the microscopic content of tissue using macroscopic imaging. This information can be used as a biomarker for several pathologies, such as tumor characterization, osteoarthritis, and neurodegenerative diseases. Recently, deep neural network (DNN) based methods were proposed for T2 distribution estimation from MRI data. However, these methods are highly sensitive to distribution shifts such as variations in the echo-times (TE) used during acquisition. Therefore, DNN-based methods cannot be utilized in large-scale multi-institutional trials with heterogeneous acquisition protocols. We present P2T2, a new physically-primed DNN approach for T2 distribution estimation that is robust to different acquisition parameters while maintaining state-of-the-art estimation accuracy. Our P2T2 model encodes the forward model of the signal decay by taking as input the TE acquisition array, in addition to the MRI signal, and provides an estimate of the corresponding T2 distribution as its output. Our P2T2 model has improved the robustness against distribution shifts in the acquisition process by more than 50% compared to the previously proposed DNN model. When tested without any distribution shifts, our model achieved about the same accuracy. Finally, when applied to real human MRI data, our P2T2 model produced the most detailed Myelin-Water fraction maps compared to both the MIML model and classical approaches. Our proposed physically-primed approach improved the generalization capacity of DNN models for T2 distribution estimation and their robustness against distribution shifts compared to previous approaches without compromising the accuracy.

Unsupervised discretization is a crucial step in many knowledge discovery tasks. The state-of-the-art method for one-dimensional data infers locally adaptive histograms using the minimum description length (MDL) principle, but the multi-dimensional case is far less studied: current methods consider the dimensions one at a time (if not independently), which result in discretizations based on rectangular cells of adaptive size. Unfortunately, this approach is unable to adequately characterize dependencies among dimensions and/or results in discretizations consisting of more cells (or bins) than is desirable. To address this problem, we propose an expressive model class that allows for far more flexible partitions of two-dimensional data. We extend the state of the art for the one-dimensional case to obtain a model selection problem based on the normalized maximum likelihood, a form of refined MDL. As the flexibility of our model class comes at the cost of a vast search space, we introduce a heuristic algorithm, named PALM, which Partitions each dimension ALternately and then Merges neighboring regions, all using the MDL principle. Experiments on synthetic data show that PALM 1) accurately reveals ground truth partitions that are within the model class (i.e., the search space), given a large enough sample size; 2) approximates well a wide range of partitions outside the model class; 3) converges, in contrast to the state-of-the-art multivariate discretization method IPD. Finally, we apply our algorithm to three spatial datasets, and we demonstrate that, compared to kernel density estimation (KDE), our algorithm not only reveals more detailed density changes, but also fits unseen data better, as measured by the log-likelihood.

Denoising diffusion models have recently marked a milestone in high-quality image generation. One may thus wonder if they are suitable for neural image compression. This paper outlines an end-to-end optimized image compression framework based on a conditional diffusion model, drawing on the transform-coding paradigm. Besides the latent variables inherent to the diffusion process, this paper introduces an additional discrete ``content'' latent variable to condition the denoising process. This variable is equipped with a hierarchical prior for entropy coding. The remaining ``texture'' latent variables characterizing the diffusion process are synthesized (either stochastically or deterministically) at decoding time. We furthermore show that the performance can be tuned toward perceptual metrics of interest. Our extensive experiments involving five datasets and sixteen image quality assessment metrics show that our approach not only compares favorably in rate-perceptual quality but also shows close distortion performance with state-of-the-art models.

As Artificial and Robotic Systems are increasingly deployed and relied upon for real-world applications, it is important that they exhibit the ability to continually learn and adapt in dynamically-changing environments, becoming Lifelong Learning Machines. Continual/lifelong learning (LL) involves minimizing catastrophic forgetting of old tasks while maximizing a model's capability to learn new tasks. This paper addresses the challenging lifelong reinforcement learning (L2RL) setting. Pushing the state-of-the-art forward in L2RL and making L2RL useful for practical applications requires more than developing individual L2RL algorithms; it requires making progress at the systems-level, especially research into the non-trivial problem of how to integrate multiple L2RL algorithms into a common framework. In this paper, we introduce the Lifelong Reinforcement Learning Components Framework (L2RLCF), which standardizes L2RL systems and assimilates different continual learning components (each addressing different aspects of the lifelong learning problem) into a unified system. As an instantiation of L2RLCF, we develop a standard API allowing easy integration of novel lifelong learning components. We describe a case study that demonstrates how multiple independently-developed LL components can be integrated into a single realized system. We also introduce an evaluation environment in order to measure the effect of combining various system components. Our evaluation environment employs different LL scenarios (sequences of tasks) consisting of Starcraft-2 minigames and allows for the fair, comprehensive, and quantitative comparison of different combinations of components within a challenging common evaluation environment.

We investigate whether three types of post hoc model explanations--feature attribution, concept activation, and training point ranking--are effective for detecting a model's reliance on spurious signals in the training data. Specifically, we consider the scenario where the spurious signal to be detected is unknown, at test-time, to the user of the explanation method. We design an empirical methodology that uses semi-synthetic datasets along with pre-specified spurious artifacts to obtain models that verifiably rely on these spurious training signals. We then provide a suite of metrics that assess an explanation method's reliability for spurious signal detection under various conditions. We find that the post hoc explanation methods tested are ineffective when the spurious artifact is unknown at test-time especially for non-visible artifacts like a background blur. Further, we find that feature attribution methods are susceptible to erroneously indicating dependence on spurious signals even when the model being explained does not rely on spurious artifacts. This finding casts doubt on the utility of these approaches, in the hands of a practitioner, for detecting a model's reliance on spurious signals.

Diffusion-based generative models have demonstrated a capacity for perceptually impressive synthesis, but can they also be great likelihood-based models? We answer this in the affirmative, and introduce a family of diffusion-based generative models that obtain state-of-the-art likelihoods on standard image density estimation benchmarks. Unlike other diffusion-based models, our method allows for efficient optimization of the noise schedule jointly with the rest of the model. We show that the variational lower bound (VLB) simplifies to a remarkably short expression in terms of the signal-to-noise ratio of the diffused data, thereby improving our theoretical understanding of this model class. Using this insight, we prove an equivalence between several models proposed in the literature. In addition, we show that the continuous-time VLB is invariant to the noise schedule, except for the signal-to-noise ratio at its endpoints. This enables us to learn a noise schedule that minimizes the variance of the resulting VLB estimator, leading to faster optimization. Combining these advances with architectural improvements, we obtain state-of-the-art likelihoods on image density estimation benchmarks, outperforming autoregressive models that have dominated these benchmarks for many years, with often significantly faster optimization. In addition, we show how to use the model as part of a bits-back compression scheme, and demonstrate lossless compression rates close to the theoretical optimum. Code is available at https://github.com/google-research/vdm .

Generative Adversarial Networks (GANs) were introduced by Goodfellow in 2014, and since then have become popular for constructing generative artificial intelligence models. However, the drawbacks of such networks are numerous, like their longer training times, their sensitivity to hyperparameter tuning, several types of loss and optimization functions and other difficulties like mode collapse. Current applications of GANs include generating photo-realistic human faces, animals and objects. However, I wanted to explore the artistic ability of GANs in more detail, by using existing models and learning from them. This dissertation covers the basics of neural networks and works its way up to the particular aspects of GANs, together with experimentation and modification of existing available models, from least complex to most. The intention is to see if state of the art GANs (specifically StyleGAN2) can generate album art covers and if it is possible to tailor them by genre. This was attempted by first familiarizing myself with 3 existing GANs architectures, including the state of the art StyleGAN2. The StyleGAN2 code was used to train a model with a dataset containing 80K album cover images, then used to style images by picking curated images and mixing their styles.

Machine learning methods have been lately used to solve partial differential equations (PDEs) and dynamical systems. These approaches have been developed into a novel research field known as scientific machine learning in which techniques such as deep neural networks and statistical learning are applied to classical problems of applied mathematics. In this paper, we develop a novel numerical algorithm that incorporates machine learning and artificial intelligence to solve PDEs. Based on the Legendre-Galerkin framework, we propose the {\it unsupervised machine learning} algorithm to learn {\it multiple instances} of the solutions for different types of PDEs. Our approach overcomes the limitations of data-driven and physics-based methods. The proposed neural network is applied to general 1D and 2D PDEs with various boundary conditions as well as convection-dominated {\it singularly perturbed PDEs} that exhibit strong boundary layer behavior.

Training large, deep neural networks to convergence can be prohibitively expensive. As a result, often only a small selection of popular, dense models are reused across different contexts and tasks. Increasingly, sparsely activated models, which seek to decouple model size from computation costs, are becoming an attractive alternative to dense models. Although more efficient in terms of quality and computation cost, sparse models remain data-hungry and costly to train from scratch in the large scale regime. In this work, we propose sparse upcycling -- a simple way to reuse sunk training costs by initializing a sparsely activated Mixture-of-Experts model from a dense checkpoint. We show that sparsely upcycled T5 Base, Large, and XL language models and Vision Transformer Base and Large models, respectively, significantly outperform their dense counterparts on SuperGLUE and ImageNet, using only ~50% of the initial dense pretraining sunk cost. The upcycled models also outperform sparse models trained from scratch on 100% of the initial dense pretraining computation budget.

The optimal binning is the optimal discretization of a variable into bins given a discrete or continuous numeric target. We present a rigorous and extensible mathematical programming formulation for solving the optimal binning problem for a binary, continuous and multi-class target type, incorporating constraints not previously addressed. For all three target types, we introduce a convex mixed-integer programming formulation. Several algorithmic enhancements, such as automatic determination of the most suitable monotonic trend via a Machine-Learning-based classifier and implementation aspects are thoughtfully discussed. The new mathematical programming formulations are carefully implemented in the open-source python library OptBinning.

Basecalling is an essential step in nanopore sequencing analysis where the raw signals of nanopore sequencers are converted into nucleotide sequences, i.e., reads. State-of-the-art basecallers employ complex deep learning models to achieve high basecalling accuracy. This makes basecalling computationally-inefficient and memory-hungry; bottlenecking the entire genome analysis pipeline. However, for many applications, the majority of reads do no match the reference genome of interest (i.e., target reference) and thus are discarded in later steps in the genomics pipeline, wasting the basecalling computation. To overcome this issue, we propose TargetCall, the first fast and widely-applicable pre-basecalling filter to eliminate the wasted computation in basecalling. TargetCall's key idea is to discard reads that will not match the target reference (i.e., off-target reads) prior to basecalling. TargetCall consists of two main components: (1) LightCall, a lightweight neural network basecaller that produces noisy reads; and (2) Similarity Check, which labels each of these noisy reads as on-target or off-target by matching them to the target reference. TargetCall filters out all off-target reads before basecalling; and the highly-accurate but slow basecalling is performed only on the raw signals whose noisy reads are labeled as on-target. Our thorough experimental evaluations using both real and simulated data show that TargetCall 1) improves the end-to-end basecalling performance of the state-of-the-art basecaller by 3.31x while maintaining high (98.88%) sensitivity in keeping on-target reads, 2) maintains high accuracy in downstream analysis, 3) precisely filters out up to 94.71% of off-target reads, and 4) achieves better performance, sensitivity, and generality compared to prior works. We freely open-source TargetCall at https://github.com/CMU-SAFARI/TargetCall.

Predictive coding is a message-passing framework initially developed to model information processing in the brain, and now also topic of research in machine learning due to some interesting properties. One of such properties is the natural ability of generative models to learn robust representations thanks to their peculiar credit assignment rule, that allows neural activities to converge to a solution before updating the synaptic weights. Graph neural networks are also message-passing models, which have recently shown outstanding results in diverse types of tasks in machine learning, providing interdisciplinary state-of-the-art performance on structured data. However, they are vulnerable to imperceptible adversarial attacks, and unfit for out-of-distribution generalization. In this work, we address this by building models that have the same structure of popular graph neural network architectures, but rely on the message-passing rule of predictive coding. Through an extensive set of experiments, we show that the proposed models are (i) comparable to standard ones in terms of performance in both inductive and transductive tasks, (ii) better calibrated, and (iii) robust against multiple kinds of adversarial attacks.

We propose a data-driven mean-curvature solver for the level-set method. This work is the natural extension to $\mathbb{R}^3$ of our two-dimensional strategy in [DOI: 10.1007/s10915-022-01952-2][1] and the hybrid inference system of [DOI: 10.1016/j.jcp.2022.111291][2]. However, in contrast to [1,2], which built resolution-dependent neural-network dictionaries, here we develop a pair of models in $\mathbb{R}^3$, regardless of the mesh size. Our feedforward networks ingest transformed level-set, gradient, and curvature data to fix numerical mean-curvature approximations selectively for interface nodes. To reduce the problem's complexity, we have used the Gaussian curvature to classify stencils and fit our models separately to non-saddle and saddle patterns. Non-saddle stencils are easier to handle because they exhibit a curvature error distribution characterized by monotonicity and symmetry. While the latter has allowed us to train only on half the mean-curvature spectrum, the former has helped us blend the data-driven and the baseline estimations seamlessly near flat regions. On the other hand, the saddle-pattern error structure is less clear; thus, we have exploited no latent information beyond what is known. In this regard, we have trained our models on not only spherical but also sinusoidal and hyperbolic paraboloidal patches. Our approach to building their data sets is systematic but gleans samples randomly while ensuring well-balancedness. We have also resorted to standardization and dimensionality reduction and integrated regularization to minimize outliers. In addition, we leverage curvature rotation/reflection invariance to improve precision at inference time. Several experiments confirm that our proposed system can yield more accurate mean-curvature estimations than modern particle-based interface reconstruction and level-set schemes around under-resolved regions.

We introduce a deep learning model that can universally approximate regular conditional distributions (RCDs). The proposed model operates in three phases: first, it linearizes inputs from a given metric space $\mathcal{X}$ to $\mathbb{R}^d$ via a feature map, then a deep feedforward neural network processes these linearized features, and then the network's outputs are then transformed to the $1$-Wasserstein space $\mathcal{P}_1(\mathbb{R}^D)$ via a probabilistic extension of the attention mechanism of Bahdanau et al.\ (2014). Our model, called the \textit{probabilistic transformer (PT)}, can approximate any continuous function from $\mathbb{R}^d $ to $\mathcal{P}_1(\mathbb{R}^D)$ uniformly on compact sets, quantitatively. We identify two ways in which the PT avoids the curse of dimensionality when approximating $\mathcal{P}_1(\mathbb{R}^D)$-valued functions. The first strategy builds functions in $C(\mathbb{R}^d,\mathcal{P}_1(\mathbb{R}^D))$ which can be efficiently approximated by a PT, uniformly on any given compact subset of $\mathbb{R}^d$. In the second approach, given any function $f$ in $C(\mathbb{R}^d,\mathcal{P}_1(\mathbb{R}^D))$, we build compact subsets of $\mathbb{R}^d$ whereon $f$ can be efficiently approximated by a PT.

Despite the impact of psychiatric disorders on clinical health, early-stage diagnosis remains a challenge. Machine learning studies have shown that classifiers tend to be overly narrow in the diagnosis prediction task. The overlap between conditions leads to high heterogeneity among participants that is not adequately captured by classification models. To address this issue, normative approaches have surged as an alternative method. By using a generative model to learn the distribution of healthy brain data patterns, we can identify the presence of pathologies as deviations or outliers from the distribution learned by the model. In particular, deep generative models showed great results as normative models to identify neurological lesions in the brain. However, unlike most neurological lesions, psychiatric disorders present subtle changes widespread in several brain regions, making these alterations challenging to identify. In this work, we evaluate the performance of transformer-based normative models to detect subtle brain changes expressed in adolescents and young adults. We trained our model on 3D MRI scans of neurotypical individuals (N=1,765). Then, we obtained the likelihood of neurotypical controls and psychiatric patients with early-stage schizophrenia from an independent dataset (N=93) from the Human Connectome Project. Using the predicted likelihood of the scans as a proxy for a normative score, we obtained an AUROC of 0.82 when assessing the difference between controls and individuals with early-stage schizophrenia. Our approach surpassed recent normative methods based on brain age and Gaussian Process, showing the promising use of deep generative models to help in individualised analyses.

Computational fluid dynamics (CFD) is a valuable asset for patient-specific cardiovascular-disease diagnosis and prognosis, but its high computational demands hamper its adoption in practice. Machine-learning methods that estimate blood flow in individual patients could accelerate or replace CFD simulation to overcome these limitations. In this work, we consider the estimation of vector-valued quantities on the wall of three-dimensional geometric artery models. We employ group-equivariant graph convolution in an end-to-end SE(3)-equivariant neural network that operates directly on triangular surface meshes and makes efficient use of training data. We run experiments on a large dataset of synthetic coronary arteries and find that our method estimates directional wall shear stress (WSS) with an approximation error of 7.6% and normalised mean absolute error (NMAE) of 0.4% while up to two orders of magnitude faster than CFD. Furthermore, we show that our method is powerful enough to accurately predict transient, vector-valued WSS over the cardiac cycle while conditioned on a range of different inflow boundary conditions. These results demonstrate the potential of our proposed method as a plugin replacement for CFD in the personalised prediction of hemodynamic vector and scalar fields.

This paper considers a market for trading Internet of Things (IoT) data that is used to train machine learning models. The data, either raw or processed, is supplied to the market platform through a network and the price of such data is controlled based on the value it brings to the machine learning model. We explore the correlation property of data in a game-theoretical setting to eventually derive a simplified distributed solution for a data trading mechanism that emphasizes the mutual benefit of devices and the market. The key proposal is an efficient algorithm for markets that jointly addresses the challenges of availability and heterogeneity in participation, as well as the transfer of trust and the economic value of data exchange in IoT networks. The proposed approach establishes the data market by reinforcing collaboration opportunities between device with correlated data to avoid information leakage. Therein, we develop a network-wide optimization problem that maximizes the social value of coalition among the IoT devices of similar data types; at the same time, it minimizes the cost due to network externalities, i.e., the impact of information leakage due to data correlation, as well as the opportunity costs. Finally, we reveal the structure of the formulated problem as a distributed coalition game and solve it following the simplified split-and-merge algorithm. Simulation results show the efficacy of our proposed mechanism design toward a trusted IoT data market, with up to 32.72% gain in the average payoff for each seller.

In a mixed generalized linear model, the objective is to learn multiple signals from unlabeled observations: each sample comes from exactly one signal, but it is not known which one. We consider the prototypical problem of estimating two statistically independent signals in a mixed generalized linear model with Gaussian covariates. Spectral methods are a popular class of estimators which output the top two eigenvectors of a suitable data-dependent matrix. However, despite the wide applicability, their design is still obtained via heuristic considerations, and the number of samples $n$ needed to guarantee recovery is super-linear in the signal dimension $d$. In this paper, we develop exact asymptotics on spectral methods in the challenging proportional regime in which $n, d$ grow large and their ratio converges to a finite constant. By doing so, we are able to optimize the design of the spectral method, and combine it with a simple linear estimator, in order to minimize the estimation error. Our characterization exploits a mix of tools from random matrices, free probability and the theory of approximate message passing algorithms. Numerical simulations for mixed linear regression and phase retrieval display the advantage enabled by our analysis over existing designs of spectral methods.

Most regularized tensor regression research focuses on tensors predictors with scalars responses or vectors predictors to tensors responses. We consider the sparse low rank tensor on tensor regression where predictors $\mathcal{X}$ and responses $\mathcal{Y}$ are both high-dimensional tensors. By demonstrating that the general inner product or the contracted product on a unit rank tensor can be decomposed into standard inner products and outer products, the problem can be simply transformed into a tensor to scalar regression followed by a tensor decomposition. So we propose a fast solution based on stagewise search composed by contraction part and generation part which are optimized alternatively. We successfully demonstrate our method can out perform current methods in terms of accuracy, predictors selection by effectively incorporating the structural information.

A new method for solving the wave equation is presented, called the learned Born series (LBS), which is derived from a convergent Born Series but its components are found through training. The LBS is shown to be significantly more accurate than the convergent Born series for the same number of iterations, in the presence of high contrast scatterers, while maintaining a comparable computational complexity. The LBS is able to generate a reasonable prediction of the global pressure field with a small number of iterations, and the errors decrease with the number of learned iterations.

Open peer review is a growing trend in academic publications. Public access to peer review data can benefit both the academic and publishing communities. It also serves as a great support to studies on review comment generation and further to the realization of automated scholarly paper review. However, most of the existing peer review datasets do not provide data that cover the whole peer review process. Apart from this, their data are not diversified enough as they are mainly collected from the field of computer science. These two drawbacks of the currently available peer review datasets need to be addressed to unlock more opportunities for related studies. In response to this problem, we construct MOPRD, a multidisciplinary open peer review dataset. This dataset consists of paper metadata, multiple version manuscripts, review comments, meta-reviews, author's rebuttal letters, and editorial decisions. Moreover, we design a modular guided review comment generation method based on MOPRD. Experiments show that our method delivers better performance indicated by both automatic metrics and human evaluation. We also explore other potential applications of MOPRD, including meta-review generation, editorial decision prediction, author rebuttal generation, and scientometric analysis. MOPRD is a strong endorsement for further studies in peer review-related research and other applications.

We first prove that Littlestone classes, those which model theorists call stable, characterize learnability in a new statistical model: a learner in this new setting outputs the same hypothesis, up to measure zero, with probability one, after a uniformly bounded number of revisions. This fills a certain gap in the literature, and sets the stage for an approximation theorem characterizing Littlestone classes in terms of a range of learning models, by analogy to definability of types in model theory. We then give a complete analogue of Shelah's celebrated (and perhaps a priori untranslatable) Unstable Formula Theorem in the learning setting, with algorithmic arguments taking the place of the infinite.

Denoising diffusion models hold great promise for generating diverse and realistic human motions. However, existing motion diffusion models largely disregard the laws of physics in the diffusion process and often generate physically-implausible motions with pronounced artifacts such as floating, foot sliding, and ground penetration. This seriously impacts the quality of generated motions and limits their real-world application. To address this issue, we present a novel physics-guided motion diffusion model (PhysDiff), which incorporates physical constraints into the diffusion process. Specifically, we propose a physics-based motion projection module that uses motion imitation in a physics simulator to project the denoised motion of a diffusion step to a physically-plausible motion. The projected motion is further used in the next diffusion step to guide the denoising diffusion process. Intuitively, the use of physics in our model iteratively pulls the motion toward a physically-plausible space. Experiments on large-scale human motion datasets show that our approach achieves state-of-the-art motion quality and improves physical plausibility drastically (>78% for all datasets).

A lot of theoretical and empirical evidence shows that the flatter local minima tend to improve generalization. Adversarial Weight Perturbation (AWP) is an emerging technique to efficiently and effectively find such minima. In AWP we minimize the loss w.r.t. a bounded worst-case perturbation of the model parameters thereby favoring local minima with a small loss in a neighborhood around them. The benefits of AWP, and more generally the connections between flatness and generalization, have been extensively studied for i.i.d. data such as images. In this paper, we extensively study this phenomenon for graph data. Along the way, we first derive a generalization bound for non-i.i.d. node classification tasks. Then we identify a vanishing-gradient issue with all existing formulations of AWP and we propose a new Weighted Truncated AWP (WT-AWP) to alleviate this issue. We show that regularizing graph neural networks with WT-AWP consistently improves both natural and robust generalization across many different graph learning tasks and models.

Self-supervised learning (SSL) learns useful representations from unlabelled data by training networks to be invariant to pairs of augmented versions of the same input. Non-contrastive methods avoid collapse either by directly regularizing the covariance matrix of network outputs or through asymmetric loss architectures, two seemingly unrelated approaches. Here, by building on DirectPred, we lay out a theoretical framework that reconciles these two views. We derive analytical expressions for the representational learning dynamics in linear networks. By expressing them in the eigenspace of the embedding covariance matrix, where the solutions decouple, we reveal the mechanism and conditions that provide implicit variance regularization. These insights allow us to formulate a new isotropic loss function that equalizes eigenvalue contribution and renders learning more robust. Finally, we show empirically that our findings translate to nonlinear networks trained on CIFAR-10 and STL-10.

Large-scale data is an essential component of machine learning as demonstrated in recent advances in natural language processing and computer vision research. However, collecting large-scale robotic data is much more expensive and slower as each operator can control only a single robot at a time. To make this costly data collection process efficient and scalable, we propose Policy Assisted TeleOperation (PATO), a system which automates part of the demonstration collection process using a learned assistive policy. PATO autonomously executes repetitive behaviors in data collection and asks for human input only when it is uncertain about which subtask or behavior to execute. We conduct teleoperation user studies both with a real robot and a simulated robot fleet and demonstrate that our assisted teleoperation system reduces human operators' mental load while improving data collection efficiency. Further, it enables a single operator to control multiple robots in parallel, which is a first step towards scalable robotic data collection. For code and video results, see https://clvrai.com/pato

Given a resource-rich source graph and a resource-scarce target graph, how can we effectively transfer knowledge across graphs and ensure a good generalization performance? In many high-impact domains (e.g., brain networks and molecular graphs), collecting and annotating data is prohibitively expensive and time-consuming, which makes domain adaptation an attractive option to alleviate the label scarcity issue. In light of this, the state-of-the-art methods focus on deriving domain-invariant graph representation that minimizes the domain discrepancy. However, it has recently been shown that a small domain discrepancy loss may not always guarantee a good generalization performance, especially in the presence of disparate graph structures and label distribution shifts. In this paper, we present TRANSNET, a generic learning framework for augmenting knowledge transfer across graphs. In particular, we introduce a novel notion named trinity signal that can naturally formulate various graph signals at different granularity (e.g., node attributes, edges, and subgraphs). With that, we further propose a domain unification module together with a trinity-signal mixup scheme to jointly minimize the domain discrepancy and augment the knowledge transfer across graphs. Finally, comprehensive empirical results show that TRANSNET outperforms all existing approaches on seven benchmark datasets by a significant margin.

Spatial nonstationarity, the location variance of features' statistical distributions, is ubiquitous in many natural settings. For example, in geological reservoirs rock matrix porosity varies vertically due to geomechanical compaction trends, in mineral deposits grades vary due to sedimentation and concentration processes, in hydrology rainfall varies due to the atmosphere and topography interactions, and in metallurgy crystalline structures vary due to differential cooling. Conventional geostatistical modeling workflows rely on the assumption of stationarity to be able to model spatial features for the geostatistical inference. Nevertheless, this is often not a realistic assumption when dealing with nonstationary spatial data and this has motivated a variety of nonstationary spatial modeling workflows such as trend and residual decomposition, cosimulation with secondary features, and spatial segmentation and independent modeling over stationary subdomains. The advent of deep learning technologies has enabled new workflows for modeling spatial relationships. However, there is a paucity of demonstrated best practice and general guidance on mitigation of spatial nonstationarity with deep learning in the geospatial context. We demonstrate the impact of two common types of geostatistical spatial nonstationarity on deep learning model prediction performance and propose the mitigation of such impacts using self-attention (vision transformer) models. We demonstrate the utility of vision transformers for the mitigation of nonstationarity with relative errors as low as 10%, exceeding the performance of alternative deep learning methods such as convolutional neural networks. We establish best practice by demonstrating the ability of self-attention networks for modeling large-scale spatial relationships in the presence of commonly observed geospatial nonstationarity.

The Extremal River Problem has emerged as a flagship problem for causal discovery in extreme values of a network. The task is to recover a river network from only extreme flow measured at a set $V$ of stations, without any information on the stations' locations. We present QTree, a new simple and efficient algorithm to solve the Extremal River Problem that performs very well compared to existing methods on hydrology data and in simulations. QTree returns a root-directed tree and achieves almost perfect recovery on the Upper Danube network data, the existing benchmark data set, as well as on new data from the Lower Colorado River network in Texas. It can handle missing data, has an automated parameter tuning procedure, and runs in time $O(n |V|^2)$, where $n$ is the number of observations and $|V|$ the number of nodes in the graph. Furthermore, we prove that the QTree estimator is consistent under a Bayesian network model for extreme values with noise. We also assess the small sample behaviour of QTree through simulations and detail the strengths and possible limitations of QTree.

Machine learning-based modeling of physical systems has experienced increased interest in recent years. Despite some impressive progress, there is still a lack of benchmarks for Scientific ML that are easy to use but still challenging and representative of a wide range of problems. We introduce PDEBench, a benchmark suite of time-dependent simulation tasks based on Partial Differential Equations (PDEs). PDEBench comprises both code and data to benchmark the performance of novel machine learning models against both classical numerical simulations and machine learning baselines. Our proposed set of benchmark problems contribute the following unique features: (1) A much wider range of PDEs compared to existing benchmarks, ranging from relatively common examples to more realistic and difficult problems; (2) much larger ready-to-use datasets compared to prior work, comprising multiple simulation runs across a larger number of initial and boundary conditions and PDE parameters; (3) more extensible source codes with user-friendly APIs for data generation and baseline results with popular machine learning models (FNO, U-Net, PINN, Gradient-Based Inverse Method). PDEBench allows researchers to extend the benchmark freely for their own purposes using a standardized API and to compare the performance of new models to existing baseline methods. We also propose new evaluation metrics with the aim to provide a more holistic understanding of learning methods in the context of Scientific ML. With those metrics we identify tasks which are challenging for recent ML methods and propose these tasks as future challenges for the community. The code is available at https://github.com/pdebench/PDEBench.

Numerical simulations are ubiquitous in science and engineering. Machine learning for science investigates how artificial neural architectures can learn from these simulations to speed up scientific discovery and engineering processes. Most of these architectures are trained in a supervised manner. They require tremendous amounts of data from simulations that are slow to generate and memory greedy. In this article, we present our ongoing work to design a training framework that alleviates those bottlenecks. It generates data in parallel with the training process. Such simultaneity induces a bias in the data available during the training. We present a strategy to mitigate this bias with a memory buffer. We test our framework on the multi-parametric Lorenz's attractor. We show the benefit of our framework compared to offline training and the success of our data bias mitigation strategy to capture the complex chaotic dynamics of the system.

A main research goal in various studies is to use an observational data set and provide a new set of counterfactual guidelines that can yield causal improvements. Dynamic Treatment Regimes (DTRs) are widely studied to formalize this process. However, available methods in finding optimal DTRs often rely on assumptions that are violated in real-world applications (e.g., medical decision-making or public policy), especially when (a) the existence of unobserved confounders cannot be ignored, and (b) the unobserved confounders are time-varying (e.g., affected by previous actions). When such assumptions are violated, one often faces ambiguity regarding the underlying causal model. This ambiguity is inevitable, since the dynamics of unobserved confounders and their causal impact on the observed part of the data cannot be understood from the observed data. Motivated by a case study of finding superior treatment regimes for patients who underwent transplantation in our partner hospital and faced a medical condition known as New Onset Diabetes After Transplantation (NODAT), we extend DTRs to a new class termed Ambiguous Dynamic Treatment Regimes (ADTRs), in which the causal impact of treatment regimes is evaluated based on a "cloud" of causal models. We then connect ADTRs to Ambiguous Partially Observable Mark Decision Processes (APOMDPs) and develop Reinforcement Learning methods, which enable using the observed data to efficiently learn an optimal treatment regime. We establish theoretical results for these learning methods, including (weak) consistency and asymptotic normality. We further evaluate the performance of these learning methods both in our case study and in simulation experiments.

This paper proposes a novel kernel-based optimization scheme to handle tasks in the analysis, e.g., signal spectral estimation and single-channel source separation of 1D non-stationary oscillatory data. The key insight of our optimization scheme for reconstructing the time-frequency information is that when a nonparametric regression is applied on some input values, the output regressed points would lie near the oscillatory pattern of the oscillatory 1D signal only if these input values are a good approximation of the ground-truth phase function. In this work, Gaussian Process (GP) is chosen to conduct this nonparametric regression: the oscillatory pattern is encoded as the Pattern-inducing Points (PiPs) which act as the training data points in the GP regression; while the targeted phase function is fed in to compute the correlation kernels, acting as the testing input. Better approximated phase function generates more precise kernels, thus resulting in smaller optimization loss error when comparing the kernel-based regression output with the original signals. To the best of our knowledge, this is the first algorithm that can satisfactorily handle fully non-stationary oscillatory data, close and crossover frequencies, and general oscillatory patterns. Even in the example of a signal {produced by slow variation in the parameters of a trigonometric expansion}, we show that PiPs admits competitive or better performance in terms of accuracy and robustness than existing state-of-the-art algorithms.

As a successful approach to self-supervised learning, contrastive learning aims to learn invariant information shared among distortions of the input sample. While contrastive learning has yielded continuous advancements in sampling strategy and architecture design, it still remains two persistent defects: the interference of task-irrelevant information and sample inefficiency, which are related to the recurring existence of trivial constant solutions. From the perspective of dimensional analysis, we find out that the dimensional redundancy and dimensional confounder are the intrinsic issues behind the phenomena, and provide experimental evidence to support our viewpoint. We further propose a simple yet effective approach MetaMask, short for the dimensional Mask learned by Meta-learning, to learn representations against dimensional redundancy and confounder. MetaMask adopts the redundancy-reduction technique to tackle the dimensional redundancy issue and innovatively introduces a dimensional mask to reduce the gradient effects of specific dimensions containing the confounder, which is trained by employing a meta-learning paradigm with the objective of improving the performance of masked representations on a typical self-supervised task. We provide solid theoretical analyses to prove MetaMask can obtain tighter risk bounds for downstream classification compared to typical contrastive methods. Empirically, our method achieves state-of-the-art performance on various benchmarks.

Motivated by personalized healthcare and other applications involving sensitive data, we study online exploration in reinforcement learning with differential privacy (DP) constraints. Existing work on this problem established that no-regret learning is possible under joint differential privacy (JDP) and local differential privacy (LDP) but did not provide an algorithm with optimal regret. We close this gap for the JDP case by designing an $\epsilon$-JDP algorithm with a regret of $\widetilde{O}(\sqrt{SAH^2T}+S^2AH^3/\epsilon)$ which matches the information-theoretic lower bound of non-private learning for all choices of $\epsilon> S^{1.5}A^{0.5} H^2/\sqrt{T}$. In the above, $S$, $A$ denote the number of states and actions, $H$ denotes the planning horizon, and $T$ is the number of steps. To the best of our knowledge, this is the first private RL algorithm that achieves \emph{privacy for free} asymptotically as $T\rightarrow \infty$. Our techniques -- which could be of independent interest -- include privately releasing Bernstein-type exploration bonuses and an improved method for releasing visitation statistics. The same techniques also imply a slightly improved regret bound for the LDP case.

Solving partial differential equations is difficult. Recently proposed neural resolution-invariant models, despite their effectiveness and efficiency, usually require equispaced spatial points of data. However, sampling in spatial domain is sometimes inevitably non-equispaced in real-world systems, limiting their applicability. In this paper, we propose a Non-equispaced Fourier PDE Solver (\textsc{NFS}) with adaptive interpolation on resampled equispaced points and a variant of Fourier Neural Operators as its components. Experimental results on complex PDEs demonstrate its advantages in accuracy and efficiency. Compared with the spatially-equispaced benchmark methods, it achieves superior performance with $42.85\%$ improvements on MAE, and is able to handle non-equispaced data with a tiny loss of accuracy. Besides, to our best knowledge, \textsc{NFS} is the first ML-based method with mesh invariant inference ability to successfully model turbulent flows in non-equispaced scenarios, with a minor deviation of the error on unseen spatial points.

Electricity prices in liberalized markets are determined by the supply and demand for electric power, which are in turn driven by various external influences that vary strongly in time. In perfect competition, the merit order principle describes that dispatchable power plants enter the market in the order of their marginal costs to meet the residual load, i.e. the difference of load and renewable generation. Many market models implement this principle to predict electricity prices but typically require certain assumptions and simplifications. In this article, we present an explainable machine learning model for the prices on the German day-ahead market, which substantially outperforms a benchmark model based on the merit order principle. Our model is designed for the ex-post analysis of prices and thus builds on various external features. Using Shapley Additive exPlanation (SHAP) values, we can disentangle the role of the different features and quantify their importance from empiric data. Load, wind and solar generation are most important, as expected, but wind power appears to affect prices stronger than solar power does. Fuel prices also rank highly and show nontrivial dependencies, including strong interactions with other features revealed by a SHAP interaction analysis. Large generation ramps are correlated with high prices, again with strong feature interactions, due to the limited flexibility of nuclear and lignite plants. Our results further contribute to model development by providing quantitative insights directly from data.

Complementary recommendation gains increasing attention in e-commerce since it expedites the process of finding frequently-bought-with products for users in their shopping journey. Therefore, learning the product representation that can reflect this complementary relationship plays a central role in modern recommender systems. In this work, we propose a logical reasoning network, LOGIREC, to effectively learn embeddings of products as well as various transformations (projection, intersection, negation) between them. LOGIREC is capable of capturing the asymmetric complementary relationship between products and seamlessly extending to high-order recommendations where more comprehensive and meaningful complementary relationship is learned for a query set of products. Finally, we further propose a hybrid network that is jointly optimized for learning a more generic product representation. We demonstrate the effectiveness of our LOGIREC on multiple public real-world datasets in terms of various ranking-based metrics under both low-order and high-order recommendation scenarios.

Single-channel deep speech enhancement approaches often estimate a single multiplicative mask to extract clean speech without a measure of its accuracy. Instead, in this work, we propose to quantify the uncertainty associated with clean speech estimates in neural network-based speech enhancement. Predictive uncertainty is typically categorized into aleatoric uncertainty and epistemic uncertainty. The former accounts for the inherent uncertainty in data and the latter corresponds to the model uncertainty. Aiming for robust clean speech estimation and efficient predictive uncertainty quantification, we propose to integrate statistical complex Gaussian mixture models (CGMMs) into a deep speech enhancement framework. More specifically, we model the dependency between input and output stochastically by means of a conditional probability density and train a neural network to map the noisy input to the full posterior distribution of clean speech, modeled as a mixture of multiple complex Gaussian components. Experimental results on different datasets show that the proposed algorithm effectively captures predictive uncertainty and that combining powerful statistical models and deep learning also delivers a superior speech enhancement performance.

Many practical applications, such as recommender systems and learning to rank, involve solving multiple similar tasks. One example is learning of recommendation policies for users with similar movie preferences, where the users may still rank the individual movies slightly differently. Such tasks can be organized in a hierarchy, where similar tasks are related through a shared structure. In this work, we formulate this problem as a contextual off-policy optimization in a hierarchical graphical model from logged bandit feedback. To solve the problem, we propose a hierarchical off-policy optimization algorithm (HierOPO), which estimates the parameters of the hierarchical model and then acts pessimistically with respect to them. We instantiate HierOPO in linear Gaussian models, for which we also provide an efficient implementation and analysis. We prove per-task bounds on the suboptimality of the learned policies, which show a clear improvement over not using the hierarchical model. We also evaluate the policies empirically. Our theoretical and empirical results show a clear advantage of using the hierarchy over solving each task independently.

We propose Medical Entity Definition-based Sentence Embedding (MED-SE), a novel unsupervised contrastive learning framework designed for clinical texts, which exploits the definitions of medical entities. To this end, we conduct an extensive analysis of multiple sentence embedding techniques in clinical semantic textual similarity (STS) settings. In the entity-centric setting that we have designed, MED-SE achieves significantly better performance, while the existing unsupervised methods including SimCSE show degraded performance. Our experiments elucidate the inherent discrepancies between the general- and clinical-domain texts, and suggest that entity-centric contrastive approaches may help bridge this gap and lead to a better representation of clinical sentences.

In this paper, we introduce PDE-LEARN, a novel PDE discovery algorithm that can identify governing partial differential equations (PDEs) directly from noisy, limited measurements of a physical system of interest. PDE-LEARN uses a Rational Neural Network, $U$, to approximate the system response function and a sparse, trainable vector, $\xi$, to characterize the hidden PDE that the system response function satisfies. Our approach couples the training of $U$ and $\xi$ using a loss function that (1) makes $U$ approximate the system response function, (2) encapsulates the fact that $U$ satisfies a hidden PDE that $\xi$ characterizes, and (3) promotes sparsity in $\xi$ using ideas from iteratively reweighted least-squares. Further, PDE-LEARN can simultaneously learn from several data sets, allowing it to incorporate results from multiple experiments. This approach yields a robust algorithm to discover PDEs directly from realistic scientific data. We demonstrate the efficacy of PDE-LEARN by identifying several PDEs from noisy and limited measurements.

Artificial intelligence has made great progress in medical data analysis, but the lack of robustness and trustworthiness has kept these methods from being widely deployed. As it is not possible to train networks that are accurate in all situations, models must recognize situations where they cannot operate confidently. Bayesian deep learning methods sample the model parameter space to estimate uncertainty, but these parameters are often subject to the same vulnerabilities, which can be exploited by adversarial attacks. We propose a novel ensemble approach based on feature decorrelation and Fourier partitioning for teaching networks diverse complementary features, reducing the chance of perturbation-based fooling. We test our approach on electrocardiogram classification, demonstrating superior accuracy confidence measurement, on a variety of adversarial attacks. For example, on our ensemble trained with both decorrelation and Fourier partitioning scored a 50.18% inference accuracy and 48.01% uncertainty accuracy (area under the curve) on {\epsilon} = 50 projected gradient descent attacks, while a conventionally trained ensemble scored 21.1% and 30.31% on these metrics respectively. Our approach does not require expensive optimization with adversarial samples and can be scaled to large problems. These methods can easily be applied to other tasks for more robust and trustworthy models.

Neural networks have revolutionized the area of artificial intelligence and introduced transformative applications to almost every scientific field and industry. However, this success comes at a great price; the energy requirements for training advanced models are unsustainable. One promising way to address this pressing issue is by developing low-energy neuromorphic hardware that directly supports the algorithm's requirements. The intrinsic non-volatility, non-linearity, and memory of spintronic devices make them appealing candidates for neuromorphic devices. Here we focus on the reservoir computing paradigm, a recurrent network with a simple training algorithm suitable for computation with spintronic devices since they can provide the properties of non-linearity and memory. We review technologies and methods for developing neuromorphic spintronic devices and conclude with critical open issues to address before such devices become widely used.

Safety certification of data-driven control techniques remains a major open problem. This work investigates backward reachability as a framework for providing collision avoidance guarantees for systems controlled by neural network (NN) policies. Because NNs are typically not invertible, existing methods conservatively assume a domain over which to relax the NN, which causes loose over-approximations of the set of states that could lead the system into the obstacle (i.e., backprojection (BP) sets). To address this issue, we introduce DRIP, an algorithm with a refinement loop on the relaxation domain, which substantially tightens the BP set bounds. Furthermore, we introduce a formulation that enables directly obtaining closed-form representations of polytopes to bound the BP sets tighter than prior work, which required solving linear programs and using hyper-rectangles. Furthermore, this work extends the NN relaxation algorithm to handle polytope domains, which further tightens the bounds on BP sets. DRIP is demonstrated in numerical experiments on control systems, including a ground robot controlled by a learned NN obstacle avoidance policy.

Recent studies have found that pain in infancy has a significant impact on infant development, including psychological problems, possible brain injury, and pain sensitivity in adulthood. However, due to the lack of specialists and the fact that infants are unable to express verbally their experience of pain, it is difficult to assess infant pain. Most existing infant pain assessment systems directly apply adult methods to infants ignoring the differences between infant expressions and adult expressions. Meanwhile, as the study of facial action coding system continues to advance, the use of action units (AUs) opens up new possibilities for expression recognition and pain assessment. In this paper, a novel AuE-IPA method is proposed for assessing infant pain by leveraging different engagement levels of AUs. First, different engagement levels of AUs in infant pain are revealed, by analyzing the class activation map of an end-to-end pain assessment model. The intensities of top-engaged AUs are then used in a regression model for achieving automatic infant pain assessment. The model proposed is trained and experimented on YouTube Immunization dataset, YouTube Blood Test dataset, and iCOPEVid dataset. The experimental results show that our AuE-IPA method is more applicable to infants and possesses stronger generalization ability than end-to-end assessment model and the classic PSPI metric.

As causal inference becomes more widespread the importance of having good tools to test for causal effects increases. In this work we focus on the problem of testing for causal effects that manifest in a difference in distribution for treatment and control. We build on work applying kernel methods to causality, considering the previously introduced Counterfactual Mean Embedding framework (\textsc{CfME}). We improve on this by proposing the \emph{Doubly Robust Counterfactual Mean Embedding} (\textsc{DR-CfME}), which has better theoretical properties than its predecessor by leveraging semiparametric theory. This leads us to propose new kernel based test statistics for distributional effects which are based upon doubly robust estimators of treatment effects. We propose two test statistics, one which is a direct improvement on previous work and one which can be applied even when the support of the treatment arm is a subset of that of the control arm. We demonstrate the validity of our methods on simulated and real-world data, as well as giving an application in off-policy evaluation.

We discuss pattern languages for closed pattern mining and learning of interval data and distributional data. We first introduce pattern languages relying on pairs of intersection-based constraints or pairs of inclusion based constraints, or both, applied to intervals. We discuss the encoding of such interval patterns as itemsets thus allowing to use closed itemsets mining and formal concept analysis programs. We experiment these languages on clustering and supervised learning tasks. Then we show how to extend the approach to address distributional data.

Reliable uncertainty quantification in deep neural networks is very crucial in safety-critical applications such as automated driving for trustworthy and informed decision-making. Assessing the quality of uncertainty estimates is challenging as ground truth for uncertainty estimates is not available. Ideally, in a well-calibrated model, uncertainty estimates should perfectly correlate with model error. We propose a novel error aligned uncertainty optimization method and introduce a trainable loss function to guide the models to yield good quality uncertainty estimates aligning with the model error. Our approach targets continuous structured prediction and regression tasks, and is evaluated on multiple datasets including a large-scale vehicle motion prediction task involving real-world distributional shifts. We demonstrate that our method improves average displacement error by 1.69% and 4.69%, and the uncertainty correlation with model error by 17.22% and 19.13% as quantified by Pearson correlation coefficient on two state-of-the-art baselines.

Monumental advancements in artificial intelligence (AI) have lured the interest of doctors, lenders, judges, and other professionals. While these high-stakes decision-makers are optimistic about the technology, those familiar with AI systems are wary about the lack of transparency of its decision-making processes. Perturbation-based post hoc explainers offer a model agnostic means of interpreting these systems while only requiring query-level access. However, recent work demonstrates that these explainers can be fooled adversarially. This discovery has adverse implications for auditors, regulators, and other sentinels. With this in mind, several natural questions arise - how can we audit these black box systems? And how can we ascertain that the auditee is complying with the audit in good faith? In this work, we rigorously formalize this problem and devise a defense against adversarial attacks on perturbation-based explainers. We propose algorithms for the detection (CAD-Detect) and defense (CAD-Defend) of these attacks, which are aided by our novel conditional anomaly detection approach, KNN-CAD. We demonstrate that our approach successfully detects whether a black box system adversarially conceals its decision-making process and mitigates the adversarial attack on real-world data for the prevalent explainers, LIME and SHAP.

Cardiac resynchronization therapy (CRT) is a treatment that is used to compensate for irregularities in the heartbeat. Studies have shown that this treatment is more effective in heart patients with left bundle branch block (LBBB) arrhythmia. Therefore, identifying this arrhythmia is an important initial step in determining whether or not to use CRT. On the other hand, traditional methods for detecting LBBB on electrocardiograms (ECG) are often associated with errors. Thus, there is a need for an accurate method to diagnose this arrhythmia from ECG data. Machine learning, as a new field of study, has helped to increase human systems' performance. Deep learning, as a newer subfield of machine learning, has more power to analyze data and increase systems accuracy. This study presents a deep learning model for the detection of LBBB arrhythmia from 12-lead ECG data. This model consists of 1D dilated convolutional layers. Attention mechanism has also been used to identify important input data features and classify inputs more accurately. The proposed model is trained and validated on a database containing 10344 12-lead ECG samples using the 10-fold cross-validation method. The final results obtained by the model on the 12-lead ECG data are as follows. Accuracy: 98.80+-0.08%, specificity: 99.33+-0.11 %, F1 score: 73.97+-1.8%, and area under the receiver operating characteristics curve (AUC): 0.875+-0.0192. These results indicate that the proposed model in this study can effectively diagnose LBBB with good efficiency and, if used in medical centers, will greatly help diagnose this arrhythmia and early treatment.

California's Central Valley is the national agricultural center, producing 1/4 of the nation's food. However, land in the Central Valley is sinking at a rapid rate (as much as 20 cm per year) due to continued groundwater pumping. Land subsidence has a significant impact on infrastructure resilience and groundwater sustainability. In this study, we aim to identify specific regions with different temporal dynamics of land displacement and find relationships with underlying geological composition. Then, we aim to remotely estimate geologic composition using interferometric synthetic aperture radar (InSAR)-based land deformation temporal changes using machine learning techniques. We identified regions with different temporal characteristics of land displacement in that some areas (e.g., Helm) with coarser grain geologic compositions exhibited potentially reversible land deformation (elastic land compaction). We found a significant correlation between InSAR-based land deformation and geologic composition using random forest and deep neural network regression models. We also achieved significant accuracy with 1/4 sparse sampling to reduce any spatial correlations among data, suggesting that the model has the potential to be generalized to other regions for indirect estimation of geologic composition. Our results indicate that geologic composition can be estimated using InSAR-based land deformation data. In-situ measurements of geologic composition can be expensive and time consuming and may be impractical in some areas. The generalizability of the model sheds light on high spatial resolution geologic composition estimation utilizing existing measurements.

Emerging applications such as Deep Learning are often data-driven, thus traditional approaches based on auto-tuners are not performance effective across the wide range of inputs used in practice. In the present paper, we start an investigation of predictive models based on machine learning techniques in order to optimize Convolution Neural Networks (CNNs). As a use-case, we focus on the ARM Compute Library which provides three different implementations of the convolution operator at different numeric precision. Starting from a collation of benchmarks, we build and validate models learned by Decision Tree and naive Bayesian classifier. Preliminary experiments on Midgard-based ARM Mali GPU show that our predictive model outperforms all the convolution operators manually selected by the library.

Zero-shot quantization is a promising approach for developing lightweight deep neural networks when data is inaccessible owing to various reasons, including cost and issues related to privacy. By utilizing the learned parameters (statistics) of FP32-pre-trained models, zero-shot quantization schemes focus on generating synthetic data by minimizing the distance between the learned parameters ($\mu$ and $\sigma$) and distributions of intermediate activations. Subsequently, they distill knowledge from the pre-trained model (\textit{teacher}) to the quantized model (\textit{student}) such that the quantized model can be optimized with the synthetic dataset. In general, zero-shot quantization comprises two major elements: synthesizing datasets and quantizing models. However, thus far, zero-shot quantization has primarily been discussed in the context of quantization-aware training methods, which require task-specific losses and long-term optimization as much as retraining. We thus introduce a post-training quantization scheme for zero-shot quantization that produces high-quality quantized networks within a few hours on even half an hour. Furthermore, we propose a framework called \genie~that generates data suited for post-training quantization. With the data synthesized by \genie, we can produce high-quality quantized models without real datasets, which is comparable to few-shot quantization. We also propose a post-training quantization algorithm to enhance the performance of quantized models. By combining them, we can bridge the gap between zero-shot and few-shot quantization while significantly improving the quantization performance compared to that of existing approaches. In other words, we can obtain a unique state-of-the-art zero-shot quantization approach.

Efficient and accurate detection of subtle motion generated from small objects in noisy environments, as needed for vital sign monitoring, is challenging, but can be substantially improved with magnification. We developed a complex Gabor filter-based decomposition method to amplify phases at different spatial wavelength levels to magnify motion and extract 1D motion signals for fundamental frequency estimation. The phase-based complex Gabor filter outputs are processed and then used to train machine learning models that predict respiration and heart rate with greater accuracy. We show that our proposed technique performs better than the conventional temporal FFT-based method in clinical settings, such as sleep laboratories and emergency departments, as well for a variety of human postures.

On general regular simplicial partitions $\mathcal{T}$ of bounded polytopal domains $\Omega \subset \mathbb{R}^d$, $d\in\{2,3\}$, we construct \emph{exact neural network (NN) emulations} of all lowest order finite element spaces in the discrete de Rham complex. These include the spaces of piecewise constant functions, continuous piecewise linear (CPwL) functions, the classical ``Raviart-Thomas element'', and the ``N\'{e}d\'{e}lec edge element''. For all but the CPwL case, our network architectures employ both ReLU (rectified linear unit) and BiSU (binary step unit) activations to capture discontinuities. In the important case of CPwL functions, we prove that it suffices to work with pure ReLU nets. Our construction and DNN architecture generalizes previous results in that no geometric restrictions on the regular simplicial partitions $\mathcal{T}$ of $\Omega$ are required for DNN emulation. In addition, for CPwL functions our DNN construction is valid in any dimension $d\geq 2$. Our ``FE-Nets'' are required in the variationally correct, structure-preserving approximation of boundary value problems of electromagnetism in nonconvex polyhedra $\Omega \subset \mathbb{R}^3$. They are thus an essential ingredient in the application of e.g., the methodology of ``physics-informed NNs'' or ``deep Ritz methods'' to electromagnetic field simulation via deep learning techniques. We indicate generalizations of our constructions to higher-order compatible spaces and other, non-compatible classes of discretizations, in particular the ``Crouzeix-Raviart'' elements and Hybridized, Higher Order (HHO) methods.

Nonconvex minimax problems have attracted wide attention in machine learning, signal processing and many other fields in recent years. In this paper, we propose a primal dual alternating proximal gradient (PDAPG) algorithm and a primal dual proximal gradient (PDPG-L) algorithm for solving nonsmooth nonconvex-strongly concave and nonconvex-linear minimax problems with coupled linear constraints, respectively. The corresponding iteration complexity of the two algorithms are proved to be $\mathcal{O}\left( \varepsilon ^{-2} \right)$ and $\mathcal{O}\left( \varepsilon ^{-3} \right)$ to reach an $\varepsilon$-stationary point, respectively. To our knowledge, they are the first two algorithms with iteration complexity guarantee for solving the two classes of minimax problems.

Fingerprints are key tools in climate change detection and attribution (D&A) that are used to determine whether changes in observations are different from internal climate variability (detection), and whether observed changes can be assigned to specific external drivers (attribution). We propose a direct D&A approach based on supervised learning to extract fingerprints that lead to robust predictions under relevant interventions on exogenous variables, i.e., climate drivers other than the target. We employ anchor regression, a distributionally-robust statistical learning method inspired by causal inference that extrapolates well to perturbed data under the interventions considered. The residuals from the prediction achieve either uncorrelatedness or mean independence with the exogenous variables, thus guaranteeing robustness. We define D&A as a unified hypothesis testing framework that relies on the same statistical model but uses different targets and test statistics. In the experiments, we first show that the CO2 forcing can be robustly predicted from temperature spatial patterns under strong interventions on the solar forcing. Second, we illustrate attribution to the greenhouse gases and aerosols while protecting against interventions on the aerosols and CO2 forcing, respectively. Our study shows that incorporating robustness constraints against relevant interventions may significantly benefit detection and attribution of climate change.

This paper describes a prototype software and hardware platform to provide support to field operators during the inspection of surface defects of non-metallic pipes. Inspection is carried out by video filming defects created on the same surface in real-time using a "smart" helmet device and other mobile devices. The work focuses on the detection and recognition of the defects which appears as colored iridescence of reflected light caused by the diffraction effect arising from the presence of internal stresses in the inspected material. The platform allows you to carry out preliminary analysis directly on the device in offline mode, and, if a connection to the network is established, the received data is transmitted to the server for post-processing to extract information about possible defects that were not detected at the previous stage. The paper presents a description of the stages of design, formal description, and implementation details of the platform. It also provides descriptions of the models used to recognize defects and examples of the result of the work.

Recently, Robey et al. propose a notion of probabilistic robustness, which, at a high-level, requires a classifier to be robust to most but not all perturbations. They show that for certain hypothesis classes where proper learning under worst-case robustness is \textit{not} possible, proper learning under probabilistic robustness \textit{is} possible with sample complexity exponentially smaller than in the worst-case robustness setting. This motivates the question of whether proper learning under probabilistic robustness is always possible. In this paper, we show that this is \textit{not} the case. We exhibit examples of hypothesis classes $\mathcal{H}$ with finite VC dimension that are \textit{not} probabilistically robustly PAC learnable with \textit{any} proper learning rule. However, if we compare the output of the learner to the best hypothesis for a slightly \textit{stronger} level of probabilistic robustness, we show that not only is proper learning \textit{always} possible, but it is possible via empirical risk minimization.

Given ample experimental data from a system governed by differential equations, it is possible to use deep learning techniques to construct the underlying differential operators. In this work we perform symbolic discovery of differential operators in a situation where there is sparse experimental data. This small data regime in machine learning can be made tractable by providing our algorithms with prior information about the underlying dynamics. Physics Informed Neural Networks (PINNs) have been very successful in this regime (reconstructing entire ODE solutions using only a single point or entire PDE solutions with very few measurements of the initial condition). We modify the PINN approach by adding a neural network that learns a representation of unknown hidden terms in the differential equation. The algorithm yields both a surrogate solution to the differential equation and a black-box representation of the hidden terms. These hidden term neural networks can then be converted into symbolic equations using symbolic regression techniques like AI Feynman. In order to achieve convergence of these neural networks, we provide our algorithms with (noisy) measurements of both the initial condition as well as (synthetic) experimental data obtained at later times. We demonstrate strong performance of this approach even when provided with very few measurements of noisy data in both the ODE and PDE regime.

Hopfield networks and Boltzmann machines (BMs) are fundamental energy-based neural network models. Recent studies on modern Hopfield networks have broaden the class of energy functions and led to a unified perspective on general Hopfield networks including an attention module. In this letter, we consider the BM counterparts of modern Hopfield networks using the associated energy functions, and study their salient properties from a trainability perspective. In particular, the energy function corresponding to the attention module naturally introduces a novel BM, which we refer to as attentional BM (AttnBM). We verify that AttnBM has a tractable likelihood function and gradient for a special case and is easy to train. Moreover, we reveal the hidden connections between AttnBM and some single-layer models, namely the Gaussian--Bernoulli restricted BM and denoising autoencoder with softmax units. We also investigate BMs introduced by other energy functions, and in particular, observe that the energy function of dense associative memory models gives BMs belonging to Exponential Family Harmoniums.

Context: Machine learning (ML) may enable effective automated test generation. Objective: We characterize emerging research, examining testing practices, researcher goals, ML techniques applied, evaluation, and challenges. Methods: We perform a systematic mapping on a sample of 102 publications. Results: ML generates input for system, GUI, unit, performance, and combinatorial testing or improves the performance of existing generation methods. ML is also used to generate test verdicts, property-based, and expected output oracles. Supervised learning - often based on neural networks - and reinforcement learning - often based on Q-learning - are common, and some publications also employ unsupervised or semi-supervised learning. (Semi-/Un-)Supervised approaches are evaluated using both traditional testing metrics and ML-related metrics (e.g., accuracy), while reinforcement learning is often evaluated using testing metrics tied to the reward function. Conclusion: Work-to-date shows great promise, but there are open challenges regarding training data, retraining, scalability, evaluation complexity, ML algorithms employed - and how they are applied - benchmarks, and replicability. Our findings can serve as a roadmap and inspiration for researchers in this field.

In this work, we demonstrate the offline FPGA realization of both recurrent and feedforward neural network (NN)-based equalizers for nonlinearity compensation in coherent optical transmission systems. First, we present a realization pipeline showing the conversion of the models from Python libraries to the FPGA chip synthesis and implementation. Then, we review the main alternatives for the hardware implementation of nonlinear activation functions. The main results are divided into three parts: a performance comparison, an analysis of how activation functions are implemented, and a report on the complexity of the hardware. The performance in Q-factor is presented for the cases of bidirectional long-short-term memory coupled with convolutional NN (biLSTM + CNN) equalizer, CNN equalizer, and standard 1-StpS digital back-propagation (DBP) for the simulation and experiment propagation of a single channel dual-polarization (SC-DP) 16QAM at 34 GBd along 17x70km of LEAF. The biLSTM+CNN equalizer provides a similar result to DBP and a 1.7 dB Q-factor gain compared with the chromatic dispersion compensation baseline in the experimental dataset. After that, we assess the Q-factor and the impact of hardware utilization when approximating the activation functions of NN using Taylor series, piecewise linear, and look-up table (LUT) approximations. We also show how to mitigate the approximation errors with extra training and provide some insights into possible gradient problems in the LUT approximation. Finally, to evaluate the complexity of hardware implementation to achieve 400G throughput, fixed-point NN-based equalizers with approximated activation functions are developed and implemented in an FPGA.

Inferring reward functions from human behavior is at the center of value alignment - aligning AI objectives with what we, humans, actually want. But doing so relies on models of how humans behave given their objectives. After decades of research in cognitive science, neuroscience, and behavioral economics, obtaining accurate human models remains an open research topic. This begs the question: how accurate do these models need to be in order for the reward inference to be accurate? On the one hand, if small errors in the model can lead to catastrophic error in inference, the entire framework of reward learning seems ill-fated, as we will never have perfect models of human behavior. On the other hand, if as our models improve, we can have a guarantee that reward accuracy also improves, this would show the benefit of more work on the modeling side. We study this question both theoretically and empirically. We do show that it is unfortunately possible to construct small adversarial biases in behavior that lead to arbitrarily large errors in the inferred reward. However, and arguably more importantly, we are also able to identify reasonable assumptions under which the reward inference error can be bounded linearly in the error in the human model. Finally, we verify our theoretical insights in discrete and continuous control tasks with simulated and human data.  ( 2 min )

Offline reinforcement learning (RL) promises the ability to learn effective policies solely using existing, static datasets, without any costly online interaction. To do so, offline RL methods must handle distributional shift between the dataset and the learned policy. The most common approach is to learn conservative, or lower-bound, value functions, which underestimate the return of out-of-distribution (OOD) actions. However, such methods exhibit one notable drawback: policies optimized on such value functions can only behave according to a fixed, possibly suboptimal, degree of conservatism. However, this can be alleviated if we instead are able to learn policies for varying degrees of conservatism at training time and devise a method to dynamically choose one of them during evaluation. To do so, in this work, we propose learning value functions that additionally condition on the degree of conservatism, which we dub confidence-conditioned value functions. We derive a new form of a Bellman backup that simultaneously learns Q-values for any degree of confidence with high probability. By conditioning on confidence, our value functions enable adaptive strategies during online evaluation by controlling for confidence level using the history of observations thus far. This approach can be implemented in practice by conditioning the Q-function from existing conservative algorithms on the confidence. We theoretically show that our learned value functions produce conservative estimates of the true value at any desired confidence. Finally, we empirically show that our algorithm outperforms existing conservative offline RL algorithms on multiple discrete control domains.

A central problem in computational biophysics is protein structure prediction, i.e., finding the optimal folding of a given amino acid sequence. This problem has been studied in a classical abstract model, the HP model, where the protein is modeled as a sequence of H (hydrophobic) and P (polar) amino acids on a lattice. The objective is to find conformations maximizing H-H contacts. It is known that even in this reduced setting, the problem is intractable (NP-hard). In this work, we apply deep reinforcement learning (DRL) to the two-dimensional HP model. We can obtain the conformations of best known energies for benchmark HP sequences with lengths from 20 to 50. Our DRL is based on a deep Q-network (DQN). We find that a DQN based on long short-term memory (LSTM) architecture greatly enhances the RL learning ability and significantly improves the search process. DRL can sample the state space efficiently, without the need of manual heuristics. Experimentally we show that it can find multiple distinct best-known solutions per trial. This study demonstrates the effectiveness of deep reinforcement learning in the HP model for protein folding.

With the progress of sensor technology in wearables, the collection and analysis of PPG signals are gaining more interest. Using Machine Learning, the cardiac rhythm corresponding to PPG signals can be used to predict different tasks such as activity recognition, sleep stage detection, or more general health status. However, supervised learning is often limited by the amount of available labeled data, which is typically expensive to obtain. To address this problem, we propose a Self-Supervised Learning (SSL) method with a pretext task of signal reconstruction to learn an informative generalized PPG representation. The performance of the proposed SSL framework is compared with two fully supervised baselines. The results show that in a very limited label data setting (10 samples per class or less), using SSL is beneficial, and a simple classifier trained on SSL-learned representations outperforms fully supervised deep neural networks. However, the results reveal that the SSL-learned representations are too focused on encoding the subjects. Unfortunately, there is high inter-subject variability in the SSL-learned representations, which makes working with this data more challenging when labeled data is scarce. The high inter-subject variability suggests that there is still room for improvements in learning representations. In general, the results suggest that SSL may pave the way for the broader use of machine learning models on PPG data in label-scarce regimes.  ( 2 min )

Adversarial training is widely used to improve the robustness of deep neural networks to adversarial attack. However, adversarial training is prone to overfitting, and the cause is far from clear. This work sheds light on the mechanisms underlying overfitting through analyzing the loss landscape w.r.t. the input. We find that robust overfitting results from standard training, specifically the minimization of the clean loss, and can be mitigated by regularization of the loss gradients. Moreover, we find that robust overfitting turns severer during adversarial training partially because the gradient regularization effect of adversarial training becomes weaker due to the increase in the loss landscapes curvature. To improve robust generalization, we propose a new regularizer to smooth the loss landscape by penalizing the weighted logits variation along the adversarial direction. Our method significantly mitigates robust overfitting and achieves the highest robustness and efficiency compared to similar previous methods. Code is available at https://github.com/TreeLLi/Combating-RO-AdvLC.  ( 2 min )

The classification of sleep stages plays a crucial role in understanding and diagnosing sleep pathophysiology. Sleep stage scoring relies heavily on visual inspection by an expert that is time consuming and subjective procedure. Recently, deep learning neural network approaches have been leveraged to develop a generalized automated sleep staging and account for shifts in distributions that may be caused by inherent inter/intra-subject variability, heterogeneity across datasets, and different recording environments. However, these networks ignore the connections among brain regions, and disregard the sequential connections between temporally adjacent sleep epochs. To address these issues, this work proposes an adaptive product graph learning-based graph convolutional network, named ProductGraphSleepNet, for learning joint spatio-temporal graphs along with a bidirectional gated recurrent unit and a modified graph attention network to capture the attentive dynamics of sleep stage transitions. Evaluation on two public databases: the Montreal Archive of Sleep Studies (MASS) SS3; and the SleepEDF, which contain full night polysomnography recordings of 62 and 20 healthy subjects, respectively, demonstrates performance comparable to the state-of-the-art (Accuracy: 0.867;0.838, F1-score: 0.818;0.774 and Kappa: 0.802;0.775, on each database respectively). More importantly, the proposed network makes it possible for clinicians to comprehend and interpret the learned connectivity graphs for sleep stages.  ( 2 min )

Classical graph algorithms work well for combinatorial problems that can be thoroughly formalized and abstracted. Once the algorithm is derived, it generalizes to instances of any size. However, developing an algorithm that handles complex structures and interactions in the real world can be challenging. Rather than specifying the algorithm, we can try to learn it from the graph-structured data. Graph Neural Networks (GNNs) are inherently capable of working on graph structures; however, they struggle to generalize well, and learning on larger instances is challenging. In order to scale, we focus on a recurrent architecture design that can learn simple graph problems end to end on smaller graphs and then extrapolate to larger instances. As our main contribution, we identify three essential techniques for recurrent GNNs to scale. By using (i) skip connections, (ii) state regularization, and (iii) edge convolutions, we can guide GNNs toward extrapolation. This allows us to train on small graphs and apply the same model to much larger graphs during inference. Moreover, we empirically validate the extrapolation capabilities of our GNNs on algorithmic datasets.  ( 2 min )

Benchmark performance of deep learning classifiers alone is not a reliable predictor for the performance of a deployed model. In particular, if the image classifier has picked up spurious features in the training data, its predictions can fail in unexpected ways. In this paper, we develop a framework that allows us to systematically identify spurious features in large datasets like ImageNet. It is based on our neural PCA components and their visualization. Previous work on spurious features of image classifiers often operates in toy settings or requires costly pixel-wise annotations. In contrast, we validate our results by checking that presence of the harmful spurious feature of a class is sufficient to trigger the prediction of that class. We introduce a novel dataset "Spurious ImageNet" and check how much existing classifiers rely on spurious features.  ( 2 min )

This supplementary paper aims to introduce the Multidimensional Service Quality Scoring System (MSQs), a review-based method for quantifying host service quality mentioned and employed in the paper Exit and transition: Exploring the survival status of Airbnb listings in a time of professionalization. MSQs is not an end-to-end implementation and is essentially composed of three pipelines, namely Data Collection and Preprocessing, Objects Recognition and Grouping, and Aspect-based Service Scoring. Using the study mentioned above as a case, the technical details of MSQs are explained in this article.  ( 2 min )

This paper proposes a novel multivariate definition of statistical dependence using a functional methodology inspired by Alfred R\'enyi. We define a new symmetric and self-adjoint cross density kernel through a recursive bidirectional statistical mapping between conditional densities of continuous random processes, which estimates their statistical dependence. Therefore, the kernel eigenspectrum is proposed as a new multivariate statistical dependence measure, and the formulation requires fewer assumptions about the data generation model than current methods. The measure can also be estimated from realizations. The proposed functional maximum correlation algorithm (FMCA) is applied to a learning architecture with two multivariate neural networks. The FMCA optimal solution is an equilibrium point that estimates the eigenspectrum of the cross density kernel. Preliminary results with synthetic data and medium size image datasets corroborate the theory. Four different strategies of applying the cross density kernel are thoroughly discussed and implemented to show the versatility and stability of the methodology, and it transcends supervised learning. When two random processes are high-dimensional real-world images and white uniform noise, respectively, the algorithm learns a factorial code i.e., the occurrence of a code guarantees that a certain input in the training set was present, which is quite important for feature learning.  ( 2 min )

Real-time detection of anomalies in streaming data is receiving increasing attention as it allows us to raise alerts, predict faults, and detect intrusions or threats across industries. Yet, little attention has been given to compare the effectiveness and efficiency of anomaly detectors for streaming data (i.e., of online algorithms). In this paper, we present a qualitative, synthetic overview of major online detectors from different algorithmic families (i.e., distance, density, tree or projection-based) and highlight their main ideas for constructing, updating and testing detection models. Then, we provide a thorough analysis of the results of a quantitative experimental evaluation of online detection algorithms along with their offline counterparts. The behavior of the detectors is correlated with the characteristics of different datasets (i.e., meta-features), thereby providing a meta-level analysis of their performance. Our study addresses several missing insights from the literature such as (a) how reliable are detectors against a random classifier and what dataset characteristics make them perform randomly; (b) to what extent online detectors approximate the performance of offline counterparts; (c) which sketch strategy and update primitives of detectors are best to detect anomalies visible only within a feature subspace of a dataset; (d) what are the tradeoffs between the effectiveness and the efficiency of detectors belonging to different algorithmic families; (e) which specific characteristics of datasets yield an online algorithm to outperform all others.

When beginners learn to speak a non-native language, it is difficult for them to judge for themselves whether they are speaking well. Therefore, computer-assisted pronunciation training systems are used to detect learner mispronunciations. These systems typically compare the user's speech with that of a specific native speaker as a model in units of rhythm, phonemes, or words and calculate the differences. However, they require extensive speech data with detailed annotations or can only compare with one specific native speaker. To overcome these problems, we propose a new language learning support system that calculates speech scores and detects mispronunciations by beginners based on a small amount of unannotated speech data without comparison to a specific person. The proposed system uses deep learning--based speech processing to display the pronunciation score of the learner's speech and the difference/distance between the learner's and a group of models' pronunciation in an intuitively visual manner. Learners can gradually improve their pronunciation by eliminating differences and shortening the distance from the model until they become sufficiently proficient. Furthermore, since the pronunciation score and difference/distance are not calculated compared to specific sentences of a particular model, users are free to study the sentences they wish to study. We also built an application to help non-native speakers learn English and confirmed that it can improve users' speech intelligibility.

Wireless Sensor Network (WSN) applications reshape the trend of warehouse monitoring systems allowing them to track and locate massive numbers of logistic entities in real-time. To support the tasks, classic Radio Frequency (RF)-based localization approaches (e.g. triangulation and trilateration) confront challenges due to multi-path fading and signal loss in noisy warehouse environment. In this paper, we investigate machine learning methods using a new grid-based WSN platform called Sensor Floor that can overcome the issues. Sensor Floor consists of 345 nodes installed across the floor of our logistic research hall with dual-band RF and Inertial Measurement Unit (IMU) sensors. Our goal is to localize all logistic entities, for this study we use a mobile robot. We record distributed sensing measurements of Received Signal Strength Indicator (RSSI) and IMU values as the dataset and position tracking from Vicon system as the ground truth. The asynchronous collected data is pre-processed and trained using Random Forest and Convolutional Neural Network (CNN). The CNN model with regularization outperforms the Random Forest in terms of localization accuracy with aproximate 15 cm. Moreover, the CNN architecture can be configured flexibly depending on the scenario in the warehouse. The hardware, software and the CNN architecture of the Sensor Floor are open-source under https://github.com/FLW-TUDO/sensorfloor.  ( 2 min )

Biomedical image segmentation is one of the fastest growing fields which has seen extensive automation through the use of Artificial Intelligence. This has enabled widespread adoption of accurate techniques to expedite the screening and diagnostic processes which would otherwise take several days to finalize. In this paper, we present an end-to-end pipeline to segment lungs from chest X-ray images, training the neural network model on the Japanese Society of Radiological Technology (JSRT) dataset, using UNet to enable faster processing of initial screening for various lung disorders. The pipeline developed can be readily used by medical centers with just the provision of X-Ray images as input. The model will perform the preprocessing, and provide a segmented image as the final output. It is expected that this will drastically reduce the manual effort involved and lead to greater accessibility in resource-constrained locations.

Recent years have seen rapid progress at the intersection between causality and machine learning. Motivated by scientific applications involving high-dimensional data, in particular in biomedicine, we propose a deep neural architecture for learning causal relationships between variables from a combination of empirical data and prior causal knowledge. We combine convolutional and graph neural networks within a causal risk framework to provide a flexible and scalable approach. Empirical results include linear and nonlinear simulations (where the underlying causal structures are known and can be directly compared against), as well as a real biological example where the models are applied to high-dimensional molecular data and their output compared against entirely unseen validation experiments. These results demonstrate the feasibility of using deep learning approaches to learn causal networks in large-scale problems spanning thousands of variables.

The necessity of data driven decisions in healthcare strategy formulation is rapidly increasing. A reliable framework which helps identify factors impacting a Healthcare Provider Facility or a Hospital (from here on termed as Facility) Market Share is of key importance. This pilot study aims at developing a data driven Machine Learning - Regression framework which aids strategists in formulating key decisions to improve the Facilitys Market Share which in turn impacts in improving the quality of healthcare services. The US (United States) healthcare business is chosen for the study; and the data spanning across 60 key Facilities in Washington State and about 3 years of historical data is considered. In the current analysis Market Share is termed as the ratio of facility encounters to the total encounters among the group of potential competitor facilities. The current study proposes a novel two-pronged approach of competitor identification and regression approach to evaluate and predict market share, respectively. Leveraged model agnostic technique, SHAP, to quantify the relative importance of features impacting the market share. The proposed method to identify pool of competitors in current analysis, develops Directed Acyclic Graphs (DAGs), feature level word vectors and evaluates the key connected components at facility level. This technique is robust since its data driven which minimizes the bias from empirical techniques. Post identifying the set of competitors among facilities, developed Regression model to predict the Market share. For relative quantification of features at a facility level, incorporated SHAP a model agnostic explainer. This helped to identify and rank the attributes at each facility which impacts the market share.  ( 2 min )

To meet the fairly high safety and reliability requirements in practice, the state of health (SOH) estimation of Lithium-ion batteries (LIBs), which has a close relationship with the degradation performance, has been extensively studied with the widespread applications of various electronics. The conventional SOH estimation approaches with digital twin are end-of-cycle estimation that require the completion of a full charge/discharge cycle to observe the maximum available capacity. However, under dynamic operating conditions with partially discharged data, it is impossible to sense accurate real-time SOH estimation for LIBs. To bridge this research gap, we put forward a digital twin framework to gain the capability of sensing the battery's SOH on the fly, updating the physical battery model. The proposed digital twin solution consists of three core components to enable real-time SOH estimation without requiring a complete discharge. First, to handle the variable training cycling data, the energy discrepancy-aware cycling synchronization is proposed to align cycling data with guaranteeing the same data structure. Second, to explore the temporal importance of different training sampling times, a time-attention SOH estimation model is developed with data encoding to capture the degradation behavior over cycles, excluding adverse influences of unimportant samples. Finally, for online implementation, a similarity analysis-based data reconstruction has been put forward to provide real-time SOH estimation without requiring a full discharge cycle. Through a series of results conducted on a widely used benchmark, the proposed method yields the real-time SOH estimation with errors less than 1% for most sampling times in ongoing cycles.  ( 2 min )

Contrastive learning has emerged as a competitive pretraining method for object detection. Despite this progress, there has been minimal investigation into the robustness of contrastively pretrained detectors when faced with domain shifts. To address this gap, we conduct an empirical study of contrastive learning and out-of-domain object detection, studying how contrastive view design affects robustness. In particular, we perform a case study of the detection-focused pretext task Instance Localization (InsLoc) and propose strategies to augment views and enhance robustness in appearance-shifted and context-shifted scenarios. Amongst these strategies, we propose changes to cropping such as altering the percentage used, adding IoU constraints, and integrating saliency based object priors. We also explore the addition of shortcut-reducing augmentations such as Poisson blending, texture flattening, and elastic deformation. We benchmark these strategies on abstract, weather, and context domain shifts and illustrate robust ways to combine them, in both pretraining on single-object and multi-object image datasets. Overall, our results and insights show how to ensure robustness through the choice of views in contrastive learning.  ( 2 min )

In this paper, we present a simple yet surprisingly effective technique to induce "selective amnesia" on a backdoored model. Our approach, called SEAM, has been inspired by the problem of catastrophic forgetting (CF), a long standing issue in continual learning. Our idea is to retrain a given DNN model on randomly labeled clean data, to induce a CF on the model, leading to a sudden forget on both primary and backdoor tasks; then we recover the primary task by retraining the randomized model on correctly labeled clean data. We analyzed SEAM by modeling the unlearning process as continual learning and further approximating a DNN using Neural Tangent Kernel for measuring CF. Our analysis shows that our random-labeling approach actually maximizes the CF on an unknown backdoor in the absence of triggered inputs, and also preserves some feature extraction in the network to enable a fast revival of the primary task. We further evaluated SEAM on both image processing and Natural Language Processing tasks, under both data contamination and training manipulation attacks, over thousands of models either trained on popular image datasets or provided by the TrojAI competition. Our experiments show that SEAM vastly outperforms the state-of-the-art unlearning techniques, achieving a high Fidelity (measuring the gap between the accuracy of the primary task and that of the backdoor) within a few minutes (about 30 times faster than training a model from scratch using the MNIST dataset), with only a small amount of clean data (0.1% of training data for TrojAI models).  ( 2 min )

Deep operator network (DeepONet) has demonstrated great success in various learning tasks, including learning solution operators of partial differential equations. In particular, it provides an efficient approach to predict the evolution equations in a finite time horizon. Nevertheless, the vanilla DeepONet suffers from the issue of stability degradation in the long-time prediction. This paper proposes a {\em transfer-learning} aided DeepONet to enhance the stability. Our idea is to use transfer learning to sequentially update the DeepONets as the surrogates for propagators learned in different time frames. The evolving DeepONets can better track the varying complexities of the evolution equations, while only need to be updated by efficient training of a tiny fraction of the operator networks. Through systematic experiments, we show that the proposed method not only improves the long-time accuracy of DeepONet while maintaining similar computational cost but also substantially reduces the sample size of the training set.  ( 2 min )

This article develops a convex description of a classical or quantum learner's or agent's state of knowledge about its environment, presented as a convex subset of a commutative R-algebra. With caveats, this leads to a generalization of certain semidefinite programs in quantum information (such as those describing the universal query algorithm dual to the quantum adversary bound, related to optimal learning or control of the environment) to the classical and faulty-quantum setting, which would not be possible with a naive description via joint probability distributions over environment and internal memory. More philosophically, it also makes an interpretation of the set of reduced density matrices as "states of knowledge" of an observer of its environment, related to these techniques, more explicit. As another example, I describe and solve a formal differential equation of states of knowledge in that algebra, where an agent obtains experimental data in a Poissonian process, and its state of knowledge evolves as an exponential power series. However, this framework currently lacks impressive applications, and I post it in part to solicit feedback and collaboration on those. In particular, it may be possible to develop it into a new framework for the design of experiments, e.g. the problem of finding maximally informative questions to ask human labelers or the environment in machine-learning problems. The parts of the article not related to quantum information don't assume knowledge of it.  ( 2 min )

Bio-inspired learning has been gaining popularity recently given that Backpropagation (BP) is not considered biologically plausible. Many algorithms have been proposed in the literature which are all more biologically plausible than BP. However, apart from overcoming the biological implausibility of BP, a strong motivation for using Bio-inspired algorithms remains lacking. In this study, we undertake a holistic comparison of BP vs. multiple Bio-inspired algorithms to answer the question of whether Bio-learning offers additional benefits over BP, rather than just biological plausibility. We test Bio-algorithms under different design choices such as access to only partial training data, resource constraints in terms of the number of training epochs, sparsification of the neural network parameters and addition of noise to input samples. Through these experiments, we notably find two key advantages of Bio-algorithms over BP. Firstly, Bio-algorithms perform much better than BP when the entire training dataset is not supplied. Four of the five Bio-algorithms tested outperform BP by upto 5% accuracy when only 20% of the training dataset is available. Secondly, even when the full dataset is available, Bio-algorithms learn much quicker and converge to a stable accuracy in far lesser training epochs than BP. Hebbian learning, specifically, is able to learn in just 5 epochs compared to around 100 epochs required by BP. These insights present practical reasons for utilising Bio-learning rather than just its biological plausibility and also point towards interesting new directions for future work on Bio-learning.  ( 2 min )

Good models require good training data. For overparameterized deep models, the causal relationship between training data and model predictions is increasingly opaque and poorly understood. Influence analysis partially demystifies training's underlying interactions by quantifying the amount each training instance alters the final model. Measuring the training data's influence exactly can be provably hard in the worst case; this has led to the development and use of influence estimators, which only approximate the true influence. This paper provides the first comprehensive survey of training data influence analysis and estimation. We begin by formalizing the various, and in places orthogonal, definitions of training data influence. We then organize state-of-the-art influence analysis methods into a taxonomy; we describe each of these methods in detail and compare their underlying assumptions, asymptotic complexities, and overall strengths and weaknesses. Finally, we propose future research directions to make influence analysis more useful in practice as well as more theoretically and empirically sound. A curated, up-to-date list of resources related to influence analysis is available at https://github.com/ZaydH/influence_analysis_papers.  ( 2 min )

Contrastive learning methods based on InfoNCE loss are popular in node representation learning tasks on graph-structured data. However, its reliance on data augmentation and its quadratic computational complexity might lead to inconsistency and inefficiency problems. To mitigate these limitations, in this paper, we introduce a simple yet effective contrastive model named Localized Graph Contrastive Learning (Local-GCL in short). Local-GCL consists of two key designs: 1) We fabricate the positive examples for each node directly using its first-order neighbors, which frees our method from the reliance on carefully-designed graph augmentations; 2) To improve the efficiency of contrastive learning on graphs, we devise a kernelized contrastive loss, which could be approximately computed in linear time and space complexity with respect to the graph size. We provide theoretical analysis to justify the effectiveness and rationality of the proposed methods. Experiments on various datasets with different scales and properties demonstrate that in spite of its simplicity, Local-GCL achieves quite competitive performance in self-supervised node representation learning tasks on graphs with various scales and properties.  ( 2 min )

While human evaluation is the most reliable metric for evaluating speech generation systems, it is generally costly and time-consuming. Previous studies on automatic speech quality assessment address the problem by predicting human evaluation scores with machine learning models. However, they rely on supervised learning and thus suffer from high annotation costs and domain-shift problems. We propose SpeechLMScore, an unsupervised metric to evaluate generated speech using a speech-language model. SpeechLMScore computes the average log-probability of a speech signal by mapping it into discrete tokens and measures the average probability of generating the sequence of tokens. Therefore, it does not require human annotation and is a highly scalable framework. Evaluation results demonstrate that the proposed metric shows a promising correlation with human evaluation scores on different speech generation tasks including voice conversion, text-to-speech, and speech enhancement.  ( 2 min )

Identifying statistical regularities in solutions to some tasks in multi-task reinforcement learning can accelerate the learning of new tasks. Skill learning offers one way of identifying these regularities by decomposing pre-collected experiences into a sequence of skills. A popular approach to skill learning is maximizing the likelihood of the pre-collected experience with latent variable models, where the latent variables represent the skills. However, there are often many solutions that maximize the likelihood equally well, including degenerate solutions. To address this underspecification, we propose a new objective that combines the maximum likelihood objective with a penalty on the description length of the skills. This penalty incentivizes the skills to maximally extract common structures from the experiences. Empirically, our objective learns skills that solve downstream tasks in fewer samples compared to skills learned from only maximizing likelihood. Further, while most prior works in the offline multi-task setting focus on tasks with low-dimensional observations, our objective can scale to challenging tasks with high-dimensional image observations.  ( 2 min )

To circumvent the non-parallelizability of recurrent neural network-based equalizers, we propose knowledge distillation to recast the RNN into a parallelizable feedforward structure. The latter shows 38\% latency decrease, while impacting the Q-factor by only 0.5dB.  ( 2 min )

Reliable forecasting of traffic flow requires efficient modeling of traffic data. Different correlations and influences arise in a dynamic traffic network, making modeling a complicated task. Existing literature has proposed many different methods to capture the complex underlying spatial-temporal relations of traffic networks. However, methods still struggle to capture different local and global dependencies of long-range nature. Also, as more and more sophisticated methods are being proposed, models are increasingly becoming memory-heavy and, thus, unsuitable for low-powered devices. In this paper, we focus on solving these problems by proposing a novel deep learning framework - STLGRU. Specifically, our proposed STLGRU can effectively capture both local and global spatial-temporal relations of a traffic network using memory-augmented attention and gating mechanism. Instead of employing separate temporal and spatial components, we show that our memory module and gated unit can learn the spatial-temporal dependencies successfully, allowing for reduced memory usage with fewer parameters. We extensively experiment on several real-world traffic prediction datasets to show that our model performs better than existing methods while the memory footprint remains lower. Code is available at \url{https://github.com/Kishor-Bhaumik/STLGRU}.  ( 2 min )

Generative adversarial networks (GANs) are a class of machine-learning models that use adversarial training to generate new samples with the same (potentially very complex) statistics as the training samples. One major form of training failure, known as mode collapse, involves the generator failing to reproduce the full diversity of modes in the target probability distribution. Here, we present an effective model of GAN training, which captures the learning dynamics by replacing the generator neural network with a collection of particles in the output space; particles are coupled by a universal kernel valid for certain wide neural networks and high-dimensional inputs. The generality of our simplified model allows us to study the conditions under which mode collapse occurs. Indeed, experiments which vary the effective kernel of the generator reveal a mode collapse transition, the shape of which can be related to the type of discriminator through the frequency principle. Further, we find that gradient regularizers of intermediate strengths can optimally yield convergence through critical damping of the generator dynamics. Our effective GAN model thus provides an interpretable physical framework for understanding and improving adversarial training.  ( 2 min )

Monitoring changes inside a reservoir in real time is crucial for the success of CO2 injection and long-term storage. Machine learning (ML) is well-suited for real-time CO2 monitoring because of its computational efficiency. However, most existing applications of ML yield only one prediction (i.e., the expectation) for a given input, which may not properly reflect the distribution of the testing data, if it has a shift with respect to that of the training data. The Simultaneous Quantile Regression (SQR) method can estimate the entire conditional distribution of the target variable of a neural network via pinball loss. Here, we incorporate this technique into seismic inversion for purposes of CO2 monitoring. The uncertainty map is then calculated pixel by pixel from a particular prediction interval around the median. We also propose a novel data-augmentation method by sampling the uncertainty to further improve prediction accuracy. The developed methodology is tested on synthetic Kimberlina data, which are created by the Department of Energy and based on a CO2 capture and sequestration (CCS) project in California. The results prove that the proposed network can estimate the subsurface velocity rapidly and with sufficient resolution. Furthermore, the computed uncertainty quantifies the prediction accuracy. The method remains robust even if the testing data are distorted due to problems in the field data acquisition. Another test demonstrates the effectiveness of the developed data-augmentation method in increasing the spatial resolution of the estimated velocity field and in reducing the prediction error.  ( 2 min )

Machine Learning (ML) software has been widely adopted in modern society, with reported fairness implications for minority groups based on race, sex, age, etc. Many recent works have proposed methods to measure and mitigate algorithmic bias in ML models. The existing approaches focus on single classifier-based ML models. However, real-world ML models are often composed of multiple independent or dependent learners in an ensemble (e.g., Random Forest), where the fairness composes in a non-trivial way. How does fairness compose in ensembles? What are the fairness impacts of the learners on the ultimate fairness of the ensemble? Can fair learners result in an unfair ensemble? Furthermore, studies have shown that hyperparameters influence the fairness of ML models. Ensemble hyperparameters are more complex since they affect how learners are combined in different categories of ensembles. Understanding the impact of ensemble hyperparameters on fairness will help programmers design fair ensembles. Today, we do not understand these fully for different ensemble algorithms. In this paper, we comprehensively study popular real-world ensembles: bagging, boosting, stacking and voting. We have developed a benchmark of 168 ensemble models collected from Kaggle on four popular fairness datasets. We use existing fairness metrics to understand the composition of fairness. Our results show that ensembles can be designed to be fairer without using mitigation techniques. We also identify the interplay between fairness composition and data characteristics to guide fair ensemble design. Finally, our benchmark can be leveraged for further research on fair ensembles. To the best of our knowledge, this is one of the first and largest studies on fairness composition in ensembles yet presented in the literature.  ( 2 min )

To achieve autonomy in a priori unknown real-world scenarios, agents should be able to: i) act from high-dimensional sensory observations (e.g., images), ii) learn from past experience to adapt and improve, and iii) be capable of long horizon planning. Classical planning algorithms (e.g. PRM, RRT) are proficient at handling long-horizon planning. Deep learning based methods in turn can provide the necessary representations to address the others, by modeling statistical contingencies between observations. In this direction, we introduce a general-purpose planning algorithm called PALMER that combines classical sampling-based planning algorithms with learning-based perceptual representations. For training these perceptual representations, we combine Q-learning with contrastive representation learning to create a latent space where the distance between the embeddings of two states captures how easily an optimal policy can traverse between them. For planning with these perceptual representations, we re-purpose classical sampling-based planning algorithms to retrieve previously observed trajectory segments from a replay buffer and restitch them into approximately optimal paths that connect any given pair of start and goal states. This creates a tight feedback loop between representation learning, memory, reinforcement learning, and sampling-based planning. The end result is an experiential framework for long-horizon planning that is significantly more robust and sample efficient compared to existing methods.  ( 2 min )

Establishing open and general benchmarks has been a critical driving force behind the success of modern machine learning techniques. As machine learning is being applied to broader domains and tasks, there is a need to establish richer and more diverse benchmarks to better reflect the reality of the application scenarios. Graph learning is an emerging field of machine learning that urgently needs more and better benchmarks. To accommodate the need, we introduce Graph Learning Indexer (GLI), a benchmark curation platform for graph learning. In comparison to existing graph learning benchmark libraries, GLI highlights two novel design objectives. First, GLI is designed to incentivize \emph{dataset contributors}. In particular, we incorporate various measures to minimize the effort of contributing and maintaining a dataset, increase the usability of the contributed dataset, as well as encourage attributions to different contributors of the dataset. Second, GLI is designed to curate a knowledge base, instead of a plain collection, of benchmark datasets. We use multiple sources of meta information to augment the benchmark datasets with \emph{rich characteristics}, so that they can be easily selected and used in downstream research or development. The source code of GLI is available at \url{https://github.com/Graph-Learning-Benchmarks/gli}.  ( 2 min )

Network intrusion detection systems (NIDSs) play an important role in computer network security. There are several detection mechanisms where anomaly-based automated detection outperforms others significantly. Amid the sophistication and growing number of attacks, dealing with large amounts of data is a recognized issue in the development of anomaly-based NIDS. However, do current models meet the needs of today's networks in terms of required accuracy and dependability? In this research, we propose a new hybrid model that combines machine learning and deep learning to increase detection rates while securing dependability. Our proposed method ensures efficient pre-processing by combining SMOTE for data balancing and XGBoost for feature selection. We compared our developed method to various machine learning and deep learning algorithms to find a more efficient algorithm to implement in the pipeline. Furthermore, we chose the most effective model for network intrusion based on a set of benchmarked performance analysis criteria. Our method produces excellent results when tested on two datasets, KDDCUP'99 and CIC-MalMem-2022, with an accuracy of 99.99% and 100% for KDDCUP'99 and CIC-MalMem-2022, respectively, and no overfitting or Type-1 and Type-2 issues.  ( 2 min )

Accurate diagnosis of Alzheimer's disease (AD) is both challenging and time consuming. With a systematic approach for early detection and diagnosis of AD, steps can be taken towards the treatment and prevention of the disease. This study explores the practical application of deep learning models for diagnosis of AD. Due to computational complexity, large training times and limited availability of labelled dataset, a 3D full brain CNN (convolutional neural network) is not commonly used, and researchers often prefer 2D CNN variants. In this study, full brain 3D version of well-known 2D CNNs were designed, trained and tested for diagnosis of various stages of AD. Deep learning approach shows good performance in differentiating various stages of AD for more than 1500 full brain volumes. Along with classification, the deep learning model is capable of extracting features which are key in differentiating the various categories. The extracted features align with meaningful anatomical landmarks, that are currently considered important in identification of AD by experts. An ensemble of all the algorithm was also tested and the performance of the ensemble algorithm was superior to any individual algorithm, further improving diagnosis ability. The 3D versions of the trained CNNs and their ensemble have the potential to be incorporated in software packages that can be used by physicians/radiologists to assist them in better diagnosis of AD.  ( 2 min )

Rating a video based on its content is an important step for classifying video age categories. Movie content rating and TV show rating are the two most common rating systems established by professional committees. However, manually reviewing and evaluating scene/film content by a committee is a tedious work and it becomes increasingly difficult with the ever-growing amount of online video content. As such, a desirable solution is to use computer vision based video content analysis techniques to automate the evaluation process. In this paper, related works are summarized for action recognition, multi-modal learning, movie genre classification, and sensitive content detection in the context of content moderation and movie content rating. The project page is available at https://github.com/fcakyon/content-moderation-deep-learning}.  ( 2 min )

GAN vocoders are currently one of the state-of-the-art methods for building high-quality neural waveform generative models. However, most of their architectures require dozens of billion floating-point operations per second (GFLOPS) to generate speech waveforms in samplewise manner. This makes GAN vocoders still challenging to run on normal CPUs without accelerators or parallel computers. In this work, we propose a new architecture for GAN vocoders that mainly depends on recurrent and fully-connected networks to directly generate the time domain signal in framewise manner. This results in considerable reduction of the computational cost and enables very fast generation on both GPUs and low-complexity CPUs. Experimental results show that our Framewise WaveGAN vocoder achieves significantly higher quality than auto-regressive maximum-likelihood vocoders such as LPCNet at a very low complexity of 1.2 GFLOPS. This makes GAN vocoders more practical on edge and low-power devices.  ( 2 min )

Any quantum computing application, once encoded as a quantum circuit, must be compiled before being executable on a quantum computer. Similar to classical compilation, quantum compilation is a sequential process with many compilation steps and numerous possible optimization passes. Despite the similarities, the development of compilers for quantum computing is still in its infancy-lacking mutual consolidation on the best sequence of passes, compatibility, adaptability, and flexibility. In this work, we take advantage of decades of classical compiler optimization and propose a reinforcement learning framework for developing optimized quantum circuit compilation flows. Through distinct constraints and a unifying interface, the framework supports the combination of techniques from different compilers and optimization tools in a single compilation flow. Experimental evaluations show that the proposed framework-set up with a selection of compilation passes from IBM's Qiskit and Quantinuum's TKET-significantly outperforms both individual compilers in over 70% of cases regarding the expected fidelity. The framework is available on GitHub (https://github.com/cda-tum/MQTPredictor).  ( 2 min )

We investigate the problem of recovering a partially observed high-rank matrix whose columns obey a nonlinear structure such as a union of subspaces, an algebraic variety or grouped in clusters. The recovery problem is formulated as the rank minimization of a nonlinear feature map applied to the original matrix, which is then further approximated by a constrained non-convex optimization problem involving the Grassmann manifold. We propose two sets of algorithms, one arising from Riemannian optimization and the other as an alternating minimization scheme, both of which include first- and second-order variants. Both sets of algorithms have theoretical guarantees. In particular, for the alternating minimization, we establish global convergence and worst-case complexity bounds. Additionally, using the Kurdyka-Lojasiewicz property, we show that the alternating minimization converges to a unique limit point. We provide extensive numerical results for the recovery of union of subspaces and clustering under entry sampling and dense Gaussian sampling. Our methods are competitive with existing approaches and, in particular, high accuracy is achieved in the recovery using Riemannian second-order methods.  ( 2 min )

This paper proposes a novel kernel-based optimization scheme to handle tasks in the analysis, e.g., signal spectral estimation and single-channel source separation of 1D non-stationary oscillatory data. The key insight of our optimization scheme for reconstructing the time-frequency information is that when a nonparametric regression is applied on some input values, the output regressed points would lie near the oscillatory pattern of the oscillatory 1D signal only if these input values are a good approximation of the ground-truth phase function. In this work, Gaussian Process (GP) is chosen to conduct this nonparametric regression: the oscillatory pattern is encoded as the Pattern-inducing Points (PiPs) which act as the training data points in the GP regression; while the targeted phase function is fed in to compute the correlation kernels, acting as the testing input. Better approximated phase function generates more precise kernels, thus resulting in smaller optimization loss error when comparing the kernel-based regression output with the original signals. To the best of our knowledge, this is the first algorithm that can satisfactorily handle fully non-stationary oscillatory data, close and crossover frequencies, and general oscillatory patterns. Even in the example of a signal {produced by slow variation in the parameters of a trigonometric expansion}, we show that PiPs admits competitive or better performance in terms of accuracy and robustness than existing state-of-the-art algorithms.  ( 2 min )

Diffusion-based generative models have demonstrated a capacity for perceptually impressive synthesis, but can they also be great likelihood-based models? We answer this in the affirmative, and introduce a family of diffusion-based generative models that obtain state-of-the-art likelihoods on standard image density estimation benchmarks. Unlike other diffusion-based models, our method allows for efficient optimization of the noise schedule jointly with the rest of the model. We show that the variational lower bound (VLB) simplifies to a remarkably short expression in terms of the signal-to-noise ratio of the diffused data, thereby improving our theoretical understanding of this model class. Using this insight, we prove an equivalence between several models proposed in the literature. In addition, we show that the continuous-time VLB is invariant to the noise schedule, except for the signal-to-noise ratio at its endpoints. This enables us to learn a noise schedule that minimizes the variance of the resulting VLB estimator, leading to faster optimization. Combining these advances with architectural improvements, we obtain state-of-the-art likelihoods on image density estimation benchmarks, outperforming autoregressive models that have dominated these benchmarks for many years, with often significantly faster optimization. In addition, we show how to use the model as part of a bits-back compression scheme, and demonstrate lossless compression rates close to the theoretical optimum. Code is available at https://github.com/google-research/vdm .  ( 2 min )

We present a meta-method for initializing (seeding) the $k$-means clustering algorithm called PNN-smoothing. It consists in splitting a given dataset into $J$ random subsets, clustering each of them individually, and merging the resulting clusterings with the pairwise-nearest-neighbor (PNN) method. It is a meta-method in the sense that when clustering the individual subsets any seeding algorithm can be used. If the computational complexity of that seeding algorithm is linear in the size of the data $N$ and the number of clusters $k$, PNN-smoothing is also almost linear with an appropriate choice of $J$, and quite competitive in practice. We show empirically, using several existing seeding methods and testing on several synthetic and real datasets, that this procedure results in systematically better costs. In particular, our method of enhancing $k$-means++ seeding proves superior in both effectiveness and speed compared to the popular "greedy" $k$-means++ variant. Our implementation is publicly available at https://github.com/carlobaldassi/KMeansPNNSmoothing.jl.  ( 2 min )

Generative adversarial networks (GANs) are a class of machine-learning models that use adversarial training to generate new samples with the same (potentially very complex) statistics as the training samples. One major form of training failure, known as mode collapse, involves the generator failing to reproduce the full diversity of modes in the target probability distribution. Here, we present an effective model of GAN training, which captures the learning dynamics by replacing the generator neural network with a collection of particles in the output space; particles are coupled by a universal kernel valid for certain wide neural networks and high-dimensional inputs. The generality of our simplified model allows us to study the conditions under which mode collapse occurs. Indeed, experiments which vary the effective kernel of the generator reveal a mode collapse transition, the shape of which can be related to the type of discriminator through the frequency principle. Further, we find that gradient regularizers of intermediate strengths can optimally yield convergence through critical damping of the generator dynamics. Our effective GAN model thus provides an interpretable physical framework for understanding and improving adversarial training.

Motivated by personalized healthcare and other applications involving sensitive data, we study online exploration in reinforcement learning with differential privacy (DP) constraints. Existing work on this problem established that no-regret learning is possible under joint differential privacy (JDP) and local differential privacy (LDP) but did not provide an algorithm with optimal regret. We close this gap for the JDP case by designing an $\epsilon$-JDP algorithm with a regret of $\widetilde{O}(\sqrt{SAH^2T}+S^2AH^3/\epsilon)$ which matches the information-theoretic lower bound of non-private learning for all choices of $\epsilon> S^{1.5}A^{0.5} H^2/\sqrt{T}$. In the above, $S$, $A$ denote the number of states and actions, $H$ denotes the planning horizon, and $T$ is the number of steps. To the best of our knowledge, this is the first private RL algorithm that achieves \emph{privacy for free} asymptotically as $T\rightarrow \infty$. Our techniques -- which could be of independent interest -- include privately releasing Bernstein-type exploration bonuses and an improved method for releasing visitation statistics. The same techniques also imply a slightly improved regret bound for the LDP case.

Denoising diffusion models have recently marked a milestone in high-quality image generation. One may thus wonder if they are suitable for neural image compression. This paper outlines an end-to-end optimized image compression framework based on a conditional diffusion model, drawing on the transform-coding paradigm. Besides the latent variables inherent to the diffusion process, this paper introduces an additional discrete ``content'' latent variable to condition the denoising process. This variable is equipped with a hierarchical prior for entropy coding. The remaining ``texture'' latent variables characterizing the diffusion process are synthesized (either stochastically or deterministically) at decoding time. We furthermore show that the performance can be tuned toward perceptual metrics of interest. Our extensive experiments involving five datasets and sixteen image quality assessment metrics show that our approach not only compares favorably in rate-perceptual quality but also shows close distortion performance with state-of-the-art models.

The optimal binning is the optimal discretization of a variable into bins given a discrete or continuous numeric target. We present a rigorous and extensible mathematical programming formulation for solving the optimal binning problem for a binary, continuous and multi-class target type, incorporating constraints not previously addressed. For all three target types, we introduce a convex mixed-integer programming formulation. Several algorithmic enhancements, such as automatic determination of the most suitable monotonic trend via a Machine-Learning-based classifier and implementation aspects are thoughtfully discussed. The new mathematical programming formulations are carefully implemented in the open-source python library OptBinning.

We introduce a deep learning model that can universally approximate regular conditional distributions (RCDs). The proposed model operates in three phases: first, it linearizes inputs from a given metric space $\mathcal{X}$ to $\mathbb{R}^d$ via a feature map, then a deep feedforward neural network processes these linearized features, and then the network's outputs are then transformed to the $1$-Wasserstein space $\mathcal{P}_1(\mathbb{R}^D)$ via a probabilistic extension of the attention mechanism of Bahdanau et al.\ (2014). Our model, called the \textit{probabilistic transformer (PT)}, can approximate any continuous function from $\mathbb{R}^d $ to $\mathcal{P}_1(\mathbb{R}^D)$ uniformly on compact sets, quantitatively. We identify two ways in which the PT avoids the curse of dimensionality when approximating $\mathcal{P}_1(\mathbb{R}^D)$-valued functions. The first strategy builds functions in $C(\mathbb{R}^d,\mathcal{P}_1(\mathbb{R}^D))$ which can be efficiently approximated by a PT, uniformly on any given compact subset of $\mathbb{R}^d$. In the second approach, given any function $f$ in $C(\mathbb{R}^d,\mathcal{P}_1(\mathbb{R}^D))$, we build compact subsets of $\mathbb{R}^d$ whereon $f$ can be efficiently approximated by a PT.

The brain's spatial orientation system uses different neuron ensembles to aid in environment-based navigation. One of the ways brains encode spatial information is through grid cells, layers of decked neurons that overlay to provide environment-based navigation. These neurons fire in ensembles where several neurons fire at once to activate a single grid. We want to capture this firing structure and use it to decode grid cell data. Understanding, representing, and decoding these neural structures require models that encompass higher order connectivity than traditional graph-based models may provide. To that end, in this work, we develop a topological deep learning framework for neural spike train decoding. Our framework combines unsupervised simplicial complex discovery with the power of deep learning via a new architecture we develop herein called a simplicial convolutional recurrent neural network (SCRNN). Simplicial complexes, topological spaces that use not only vertices and edges but also higher-dimensional objects, naturally generalize graphs and capture more than just pairwise relationships. Additionally, this approach does not require prior knowledge of the neural activity beyond spike counts, which removes the need for similarity measurements. The effectiveness and versatility of the SCRNN is demonstrated on head direction data to test its performance and then applied to grid cell datasets with the task to automatically predict trajectories.  ( 2 min )

Fingerprints are key tools in climate change detection and attribution (D&A) that are used to determine whether changes in observations are different from internal climate variability (detection), and whether observed changes can be assigned to specific external drivers (attribution). We propose a direct D&A approach based on supervised learning to extract fingerprints that lead to robust predictions under relevant interventions on exogenous variables, i.e., climate drivers other than the target. We employ anchor regression, a distributionally-robust statistical learning method inspired by causal inference that extrapolates well to perturbed data under the interventions considered. The residuals from the prediction achieve either uncorrelatedness or mean independence with the exogenous variables, thus guaranteeing robustness. We define D&A as a unified hypothesis testing framework that relies on the same statistical model but uses different targets and test statistics. In the experiments, we first show that the CO2 forcing can be robustly predicted from temperature spatial patterns under strong interventions on the solar forcing. Second, we illustrate attribution to the greenhouse gases and aerosols while protecting against interventions on the aerosols and CO2 forcing, respectively. Our study shows that incorporating robustness constraints against relevant interventions may significantly benefit detection and attribution of climate change.  ( 2 min )

We study the relationship between adversarial robustness and differential privacy in high-dimensional algorithmic statistics. We give the first black-box reduction from privacy to robustness which can produce private estimators with optimal tradeoffs among sample complexity, accuracy, and privacy for a wide range of fundamental high-dimensional parameter estimation problems, including mean and covariance estimation. We show that this reduction can be implemented in polynomial time in some important special cases. In particular, using nearly-optimal polynomial-time robust estimators for the mean and covariance of high-dimensional Gaussians which are based on the Sum-of-Squares method, we design the first polynomial-time private estimators for these problems with nearly-optimal samples-accuracy-privacy tradeoffs. Our algorithms are also robust to a constant fraction of adversarially-corrupted samples.  ( 2 min )

As causal inference becomes more widespread the importance of having good tools to test for causal effects increases. In this work we focus on the problem of testing for causal effects that manifest in a difference in distribution for treatment and control. We build on work applying kernel methods to causality, considering the previously introduced Counterfactual Mean Embedding framework (\textsc{CfME}). We improve on this by proposing the \emph{Doubly Robust Counterfactual Mean Embedding} (\textsc{DR-CfME}), which has better theoretical properties than its predecessor by leveraging semiparametric theory. This leads us to propose new kernel based test statistics for distributional effects which are based upon doubly robust estimators of treatment effects. We propose two test statistics, one which is a direct improvement on previous work and one which can be applied even when the support of the treatment arm is a subset of that of the control arm. We demonstrate the validity of our methods on simulated and real-world data, as well as giving an application in off-policy evaluation.  ( 2 min )

The Extremal River Problem has emerged as a flagship problem for causal discovery in extreme values of a network. The task is to recover a river network from only extreme flow measured at a set $V$ of stations, without any information on the stations' locations. We present QTree, a new simple and efficient algorithm to solve the Extremal River Problem that performs very well compared to existing methods on hydrology data and in simulations. QTree returns a root-directed tree and achieves almost perfect recovery on the Upper Danube network data, the existing benchmark data set, as well as on new data from the Lower Colorado River network in Texas. It can handle missing data, has an automated parameter tuning procedure, and runs in time $O(n |V|^2)$, where $n$ is the number of observations and $|V|$ the number of nodes in the graph. Furthermore, we prove that the QTree estimator is consistent under a Bayesian network model for extreme values with noise. We also assess the small sample behaviour of QTree through simulations and detail the strengths and possible limitations of QTree.  ( 2 min )

A main research goal in various studies is to use an observational data set and provide a new set of counterfactual guidelines that can yield causal improvements. Dynamic Treatment Regimes (DTRs) are widely studied to formalize this process. However, available methods in finding optimal DTRs often rely on assumptions that are violated in real-world applications (e.g., medical decision-making or public policy), especially when (a) the existence of unobserved confounders cannot be ignored, and (b) the unobserved confounders are time-varying (e.g., affected by previous actions). When such assumptions are violated, one often faces ambiguity regarding the underlying causal model. This ambiguity is inevitable, since the dynamics of unobserved confounders and their causal impact on the observed part of the data cannot be understood from the observed data. Motivated by a case study of finding superior treatment regimes for patients who underwent transplantation in our partner hospital and faced a medical condition known as New Onset Diabetes After Transplantation (NODAT), we extend DTRs to a new class termed Ambiguous Dynamic Treatment Regimes (ADTRs), in which the causal impact of treatment regimes is evaluated based on a "cloud" of causal models. We then connect ADTRs to Ambiguous Partially Observable Mark Decision Processes (APOMDPs) and develop Reinforcement Learning methods, which enable using the observed data to efficiently learn an optimal treatment regime. We establish theoretical results for these learning methods, including (weak) consistency and asymptotic normality. We further evaluate the performance of these learning methods both in our case study and in simulation experiments.  ( 2 min )

Recently, Robey et al. propose a notion of probabilistic robustness, which, at a high-level, requires a classifier to be robust to most but not all perturbations. They show that for certain hypothesis classes where proper learning under worst-case robustness is \textit{not} possible, proper learning under probabilistic robustness \textit{is} possible with sample complexity exponentially smaller than in the worst-case robustness setting. This motivates the question of whether proper learning under probabilistic robustness is always possible. In this paper, we show that this is \textit{not} the case. We exhibit examples of hypothesis classes $\mathcal{H}$ with finite VC dimension that are \textit{not} probabilistically robustly PAC learnable with \textit{any} proper learning rule. However, if we compare the output of the learner to the best hypothesis for a slightly \textit{stronger} level of probabilistic robustness, we show that not only is proper learning \textit{always} possible, but it is possible via empirical risk minimization.  ( 2 min )

Unsupervised discretization is a crucial step in many knowledge discovery tasks. The state-of-the-art method for one-dimensional data infers locally adaptive histograms using the minimum description length (MDL) principle, but the multi-dimensional case is far less studied: current methods consider the dimensions one at a time (if not independently), which result in discretizations based on rectangular cells of adaptive size. Unfortunately, this approach is unable to adequately characterize dependencies among dimensions and/or results in discretizations consisting of more cells (or bins) than is desirable. To address this problem, we propose an expressive model class that allows for far more flexible partitions of two-dimensional data. We extend the state of the art for the one-dimensional case to obtain a model selection problem based on the normalized maximum likelihood, a form of refined MDL. As the flexibility of our model class comes at the cost of a vast search space, we introduce a heuristic algorithm, named PALM, which Partitions each dimension ALternately and then Merges neighboring regions, all using the MDL principle. Experiments on synthetic data show that PALM 1) accurately reveals ground truth partitions that are within the model class (i.e., the search space), given a large enough sample size; 2) approximates well a wide range of partitions outside the model class; 3) converges, in contrast to the state-of-the-art multivariate discretization method IPD. Finally, we apply our algorithm to three spatial datasets, and we demonstrate that, compared to kernel density estimation (KDE), our algorithm not only reveals more detailed density changes, but also fits unseen data better, as measured by the log-likelihood.  ( 3 min )

Hopfield networks and Boltzmann machines (BMs) are fundamental energy-based neural network models. Recent studies on modern Hopfield networks have broaden the class of energy functions and led to a unified perspective on general Hopfield networks including an attention module. In this letter, we consider the BM counterparts of modern Hopfield networks using the associated energy functions, and study their salient properties from a trainability perspective. In particular, the energy function corresponding to the attention module naturally introduces a novel BM, which we refer to as attentional BM (AttnBM). We verify that AttnBM has a tractable likelihood function and gradient for a special case and is easy to train. Moreover, we reveal the hidden connections between AttnBM and some single-layer models, namely the Gaussian--Bernoulli restricted BM and denoising autoencoder with softmax units. We also investigate BMs introduced by other energy functions, and in particular, observe that the energy function of dense associative memory models gives BMs belonging to Exponential Family Harmoniums.  ( 2 min )

Nonconvex minimax problems have attracted wide attention in machine learning, signal processing and many other fields in recent years. In this paper, we propose a primal dual alternating proximal gradient (PDAPG) algorithm and a primal dual proximal gradient (PDPG-L) algorithm for solving nonsmooth nonconvex-strongly concave and nonconvex-linear minimax problems with coupled linear constraints, respectively. The corresponding iteration complexity of the two algorithms are proved to be $\mathcal{O}\left( \varepsilon ^{-2} \right)$ and $\mathcal{O}\left( \varepsilon ^{-3} \right)$ to reach an $\varepsilon$-stationary point, respectively. To our knowledge, they are the first two algorithms with iteration complexity guarantee for solving the two classes of minimax problems.  ( 2 min )

We apply the Hierarchical Autoregressive Neural (HAN) network sampling algorithm to the two-dimensional $Q$-state Potts model and perform simulations around the phase transition at $Q=12$. We quantify the performance of the approach in the vicinity of the first-order phase transition and compare it with that of the Wolff cluster algorithm. We find a significant improvement as far as the statistical uncertainty is concerned at a similar numerical effort. In order to efficiently train large neural networks we introduce the technique of pre-training. It allows to train some neural networks using smaller system sizes and then employing them as starting configurations for larger system sizes. This is possible due to the recursive construction of our hierarchical approach. Our results serve as a demonstration of the performance of the hierarchical approach for systems exhibiting bimodal distributions. Additionally, we provide estimates of the free energy and entropy in the vicinity of the phase transition with statistical uncertainties of the order of $10^{-7}$ for the former and $10^{-3}$ for the latter based on a statistics of $10^6$ configurations.  ( 2 min )

Leopartnik’s Instagram story right now shows an AI-generated Morgan Freeman voice. What program or software did he use to create that? https://instagram.com/stories/leopartnik/2991789020620603199?utm_source=ig_story_item_share&igshid=NTdlMDg3MTY= submitted by /u/Rachel_reddit_ [link] [comments]  ( 47 min )

I am working on a motivational book and I was curious if they were an AI that can assist with writing a book? submitted by /u/LuckyAppointment8071 [link] [comments]  ( 47 min )

What are the data collection & annotation challenges that you face at your workplace & how do you resolve them? submitted by /u/Sixo60 [link] [comments]  ( 47 min )

I’m a developer who is interested in a creating products in couple different problem spaces. I want to investigate if AI can help me solve these problems; my background is not in AI. To be clear, I have problems that I want to solve; this is not “solution in search of a problem” scenario. Where do I start? What are some good ways to sort through different AI info out there to find solutions that may address the problems I’m interested in. Thanks submitted by /u/daed_murphy [link] [comments]  ( 48 min )

🥳 Do you want to create the future of artificial intelligence? Then join us for the AI Testing Hackathon where we experiment with new ways of experimenting on artificial agents! https://itch.io/jam/aitest The hackathon lasts for 48 hours of intense research hacking and you're encouraged to join with a group. 📣 We will introduce the topic with a domain expert's (speaker info coming!) talk 🔬 You can join even without experience as we'll share some amazing starter resources 🍕 We will have free food at the event 🏆 There is a prize pool of $2000 up for grabs to the best projects along with a random participation award of $200! Join our discord server for updates and to connect with other participants: https://discord.gg/wH59Fg4FCa https://preview.redd.it/b0es9d2yri5a1.png?width=997&format=png&auto=webp&s=a73e83877fbf242a74a1ccfb641919444475d9a6 submitted by /u/szsabs [link] [comments]  ( 55 min )

submitted by /u/LogicalFella [link] [comments]  ( 48 min )

submitted by /u/Mk_Makanaki [link] [comments]  ( 52 min )

Has no one think of installing an AI network on running the metro? There are still conductors conducting the metro for seemingly simple task. Or is there any difficulty that I’m not aware of? submitted by /u/Dazzling_Swordfish14 [link] [comments]  ( 47 min )

I'd like to make a war comic plz and Midjourney didn't like the pew pew. Stable Journey is too processor intensive. Anything exist that's Midjourney but with violence? submitted by /u/Professional7Account [link] [comments]  ( 48 min )

submitted by /u/niicii77 [link] [comments]  ( 50 min )

submitted by /u/EnvironmentalMap5 [link] [comments]  ( 48 min )

I mean if I could get stable defusion and then add all the images from the web, this would be amazing, right? submitted by /u/Thesmallcookie [link] [comments]  ( 49 min )

submitted by /u/bendee983 [link] [comments]  ( 71 min )

Hi there! Just want to share some tips on how to craft the right chatbot when everyone talks about ChatGPT. First of all, a custom chatbot company or any chatbot platform that does custom integration can integrate your chatbot with ChatGPT instead of Dialogflow. So yeah, you can have an outstanding customer service chatbot that can handle other topics. However, the right question is should you? If you want a chatbot that does solve issues, not creates more, you must start with the proper requirements. Well-structured chatbot requirements lay the right foundation for your future chatbot development. ChatGPT is just one of the options of how you can use AI and automation and may be not the best depending on your budget and goals. Your chatbot requirements should include these steps: - …  ( 51 min )

https://i.imgur.com/rb5ZREK.png The vampire was searching for a way to break the curse that had been placed on her. She had tried everything, from potions to spells. Nothing seemed to work. One night, while wandering the castle, she stumbled upon a secret chamber. Inside the chamber, she found a mysterious chest. When she opened it, she discovered a beautiful set of lingerie: a pink bra, bow panties, and a narrow waist cincher. The vampire was delighted by the find. She quickly changed into the lingerie and admired her reflection in the mirror. Her cleavage and navel were revealed, and her fangs peeked out from her lips. She felt beautiful and powerful. In the background, a faint aqua-colored light glowed. The vampire felt drawn to it and stepped closer. Suddenly, the light intensified, and the vampire found herself surrounded by a bright blue background. It was then that the vampire realized the lingerie was enchanted. She had been freed from the curse! The lingerie had been a gift from a secret admirer, and the light was a sign of the vampire’s newfound freedom. The vampire celebrated her newfound freedom and vowed to use her powers for good. She often wore the lingerie under her clothes as a reminder of her special night. The lingerie was now her signature look, and she was often seen wearing it with a simple background. And so, the vampire lived happily ever after, her fangs and lingerie forever a reminder of her magical night. submitted by /u/Top_Werewolf_259 [link] [comments]  ( 47 min )

submitted by /u/letsgoooz [link] [comments]  ( 48 min )

https://www.psychoftech.org/blog/2020/12/6/can-algorithms-suffer Ofcourse it will take us to understand qualia , consciousness and it's mechanism to know whether reinforcement learning based artificial agents can experience suffering. For this we need to understand what cause us to experience and can artificial intelligence gain consciousness and probably suffer due to reinforcement learning. Basically we need theory of consciousness and probably some other ways to confirm if there's any sense of experience that artificial agents might have developed. But if somehow we have a possibility of artificial intelligence gaining consciousness, then we need to make sure we don't cause suffering to such artificial intelligence based agents. submitted by /u/Beginning_Piano_7536 [link] [comments]  ( 46 min )

submitted by /u/R_K_J-DK [link] [comments]  ( 47 min )

Now that I have graduated from college, I am so clueless what path to even move forward in and not be afraid of being laid off later on. Seeing how good Chatgpt and AI art has become, i don't even know what skill to master myself in because there will be a robot better than me at that same skill. There are data scientists and software engineers who gave Chatgpt a prompt/code to find an error and give a detailed analysis/solution to that prompt. So far, it has been scarily good. I see artists living on the edge not knowing when their branding or graphic design job will be taken away from them. Chatgpt may take over journalism. I am ready to learn and adapt. I just want to know where to start from. The idea of investing my time in learning the "wrong" thing that would eventually turn obsolete is making me confused. submitted by /u/ruchi_rich_ [link] [comments]  ( 51 min )

I’ve used it before but I can’t find it again. submitted by /u/Jacarandas01 [link] [comments]  ( 46 min )

Being a college student and using this tool to help me study for finals, I have found a huge increase in productivity. For example, it helped me create study guides in seconds, rather than hours. I am wondering what university professors think about this and if anyone has any predictions about how schools will look like now that we have an AI that can literally give you all the answers to a given test with very high accuracy! I’m especially interested in us CS students, who can greatly benefit from such a tool. How would professors impose restrictions of this tool on projects or homeworks? submitted by /u/Alone_Consequence_97 [link] [comments]  ( 54 min )

A person signs up with their Google accounts and the app pulls their search history and tries to match a compatible person from key search words and deep-learning algorithm that pulls on common threads together from their words. The twist? The couple are never told what searched word(s) made them match, as an incentive to encouraging meaningful conversation when they start to talk. Would you try this? submitted by /u/SwimGood22 [link] [comments]  ( 49 min )

Does anyone know of an AI translation tool that can translate voice from English to another language? I want the result to also be a realistic voice in the other language. For example, I want to talk into something using English and I want the AI to SAY what I am saying in Spanish/other languages. submitted by /u/Desparate_Nobody [link] [comments]  ( 45 min )

After using ChatGPT, I feel like I'm using technology from ten years into the future. It's fucking mind-blowing. I'm almost certain that in the near future, AI will be better than any human at any skilled task. AI will have the ability to start companies, make amazing original music, movies, video games, etc. I'm not trying to be pessimistic or dramatic or anything, I'm just making a claim based on what I know and how fast I've seen this technology develop. Then you start to wonder, well, if in society, we value skill, and we pay money for skilled work and time, what happens when there is not longer a scarcity of skill, and a machine can do in seconds what it would take an MIT graduate to do in hours, days, months, or even years? How will our society operate? I actually don't know. I think its very probable that everything will fall apart. I'm genuinely kind of worried. submitted by /u/IAmReedHello [link] [comments]  ( 46 min )

Anatomy is the study of the structure and internal workings of an entity. There are likely many ways that organizations can determine the value of their data.  But I’m lazy, so I only teach and employ one that I know works – a use case approach that attributes the value of the organization’s data in… Read More »Anatomy of a Use Case The post Anatomy of a Use Case appeared first on Data Science Central.  ( 21 min )

The benefits of automation are improved efficiency, productivity, and quality while reducing costs. But there are also potential drawbacks, such as job loss and reduced flexibility. Therefore, when deciding whether or not to automate a task, it’s essential to weigh the pros and cons carefully. In this article, we want to consider how automation affects… Read More »Top 5 Industries That Will Be Transformed By Automation This Decade The post Top 5 Industries That Will Be Transformed By Automation This Decade appeared first on Data Science Central.  ( 22 min )

submitted by /u/ComputePls [link] [comments]  ( 56 min )

submitted by /u/gwern [link] [comments]  ( 54 min )

Hey there! I’m happy to announce that we just published the second Unit of the Deep Reinforcement Learning Course 🥳 In this Unit, we're going to dive deeper into one of the Reinforcement Learning methods: value-based methods, and study our first RL algorithm: Q-Learning. We'll also implement our first RL agent from scratch: a Q-Learning agent and will train it in two environments and share it with the community: An autonomous taxi 🚕 will need to learn to navigate a city to transport its passengers from point A to point B. Frozen-Lake-v1 ⛄ (non-slippery version): where our agent will need to go from the starting state to the goal state by walking only on frozen tiles and avoiding holes. You’ll be able to compare the results of your Q-Learning agent using our leaderboard 🏆 The Unit 👉 https://huggingface.co/deep-rl-course/unit2/introduction https://preview.redd.it/5lkustzduh5a1.jpg?width=1920&format=pjpg&auto=webp&s=082d5a160bbcb7e4a8109b04f6807cf86f7e0c68 If you didn’t sign up yet, don’t worry there’s still time, we wrote an introduction unit to help you get started. You can start learning now 👉 https://huggingface.co/deep-rl-course/unit0/introduction If you have questions or feedback, I would love to hear them 🤗 submitted by /u/cranthir_ [link] [comments]  ( 57 min )

submitted by /u/gwern [link] [comments]  ( 55 min )

are there any reference texts for parameter estimation in RL algorithms ? submitted by /u/aabra__ka__daabra [link] [comments]  ( 56 min )

submitted by /u/gwern [link] [comments]  ( 54 min )

I am reading the documentation of DQN Zoo ("https://github.com/deepmind/dqn_zoo") and came across the following paragraph - ​ " Plots show the average score at periodic evaluation phases during training. Each episode during evaluation starts with up to 30 random no-op actions and lasts a maximum of 30 minutes. To make the plots more readable, scores have been smoothed using a moving average with window size 10. " ​ I have the following questions - ​ To gauge training quality, they perform periodic evaluations. Am I right here? What does no-op mean over here? submitted by /u/Academic-Rent7800 [link] [comments]  ( 58 min )

Amazon Lookout for Vision provides a machine learning (ML)-based anomaly detection service to identify normal images (i.e., images of objects without defects) vs anomalous images (i.e., images of objects with defects), types of anomalies (e.g., missing piece), and the location of these anomalies. Therefore, Lookout for Vision is popular among customers that look for automated […]  ( 16 min )

Amazon Comprehend is a natural language processing (NLP) service that uses machine learning (ML) to discover insights from text. Amazon Comprehend provides customized features, custom entity recognition, custom classification, and pre-trained APIs such as key phrase extraction, sentiment analysis, entity recognition, and more so you can easily integrate NLP into your applications. We recently added […]  ( 8 min )

submitted by /u/mazib [link] [comments]  ( 56 min )

TL;DR: We paid USD $800 USD and spend 4 hours in the AWS Forecast console so you don't have to. In this reproducible experiment, we compare Amazon Forecast and StatsForecast a python open-source library for statistical methods. Since AWS Forecast specializes in demand forecasting, we selected the M5 competition dataset as a benchmark; the dataset contains 30,490 series of daily Walmart sales. We found that Amazon Forecast is 60% less accurate and 669 times more expensive than running an open-source alternative in a simple cloud server. We also provide a step-by-step guide to reproduce the results. Results Amazon Forecast: achieved 1.617 in error (measured in wRMSSE, the official evaluation metric used in the competition), took 4.1 hours to run, and cost 803.53 USD. An ensemble of statistical methods trained on a c5d.24xlarge EC2 instance: achieved 0.669 in error (wRMSSE), took 14.5 minutes to run, and cost only 1.2 USD. For this data set, we show, therefore, that: Amazon Forecast is 60% less accurate and 669 times more expensive than running an open-source alternative in a simple cloud server. Classical methods outperform Machine Learning methods in terms of speed, accuracy, and cost. Although using StatsForecast requires some basic knowledge of Python and cloud computing, the results are better for this dataset. Table https://preview.redd.it/vt9ru0149i5a1.png?width=1274&format=png&auto=webp&s=64e6d4519f5934d56d25d76d17a58e6d03d70512 submitted by /u/fedegarzar [link] [comments]  ( 71 min )

Details in the twitter thread: https://twitter.com/martin_gorner/status/1599755684941557761 submitted by /u/mrx-ai [link] [comments]  ( 68 min )

To Try it Now: If you want to get started straightaway, you trust my code and you're setup on CUDA (or have a virtual machine/Colab machine/etc), in the terminal, you can just run git clone https://github.com/tysam-code/hlb-CIFAR10 && cd hlb-CIFAR10 && python -m pip install -r requirements.txt && python main.py, and you should see things training straightaway. If you just want to browse the repo, feel free to head on over to https://github.com/tysam-code/hlb-CIFAR10. About the Project: Hi there, I've been working in the modern instantiation of this field for just over half a decade or so, and have always sort of wanted a good testbench to develop neural network research on. Most of the codebases I've worked with over the years have been very ad-hoc or not very close to the bleeding edg…  ( 64 min )

Does global average pooling work if the channel dimensions are big like 64x64. I feel with a channel size that big, the averaging to one pixel value will lose all the information and the model will find it very hard for the learn from it unlike a small channel dimension. submitted by /u/Ananth_A_007 [link] [comments]  ( 64 min )

submitted by /u/Illustrious_Row_9971 [link] [comments]  ( 62 min )

I am working on mapping 3D scenes from monocular videos and wanted some help on how I can use the pretrained NeuralRecon (https://zju3dv.github.io/neuralrecon/) on ScanNet dataset to reconstruct the local scene mesh around human body. For the human body dataset I am using 3DPW (https://virtualhumans.mpi-inf.mpg.de/3DPW/) dataset. submitted by /u/MaintenanceNo5993 [link] [comments]  ( 64 min )

For more than six years, Microsoft Research has been honored to develop the Soundscape research project, which was designed to deliver information about a person’s location and points of interest and has guided individuals to desired places and in unfamiliar spaces using augmented-reality and three-dimensional audio. While not a traditional turn-by-turn navigation mobile app, the […] The post Microsoft Soundscape – New Horizons with a Community-Driven Approach appeared first on Microsoft Research.  ( 11 min )

As discussed in the previous post, the Jacobi elliptic function sn(z, m) is doubly periodic in the complex plane, with period 4K(m) in the horizontal direction and period 2K(1-m) in the vertical direction. Here K is the complete elliptic integral of the first kind. The function sn(z, m) maps the rectangle (-K(m), K(m)) × (0, K(1-m)) […] Conformal map from rectangles to half plane first appeared on John D. Cook.  ( 6 min )

Here’s a calculation that I’ve had to do a few times. I’m writing it up here for my future reference and for the benefit of anybody else who needs to do the same calculation. The Jacobi sn function is doubly periodic: it has one period as you move along the real axis and another period […] Solve for Jacobi sn parameter to have given period(s) first appeared on John D. Cook.  ( 6 min )

submitted by /u/gwern [link] [comments]  ( 55 min )

submitted by /u/gwern [link] [comments]  ( 58 min )

So, I am planning on incorporating an object detection model to to solve atari games not incorporating RL strategies straightaway. The reason I am posting it in this subreddit to get a feedback from people who train models on Atari Environments. I am unable to find any supportive Labelled dataset for any of the atari games (obviously non-trivial ones). Currently as per my findings Montezuma's Revenge is one of the hardest environments, so I went on with creating an object detection model with it. But failed to comply without creating a dataset. I am an Undergrad student and I am planning to create an Object detection based atari game solver similar to well sentdex GTA-5 gameplay video. But I want to do it with Atari Games because apparently no one has incorporated proper object detection in games. submitted by /u/jashAcharjee [link] [comments]  ( 58 min )

I am trying to implement prioritized experience replay with segment trees and I had the question where, if we were to push off old experiences in the replay buffer do we need to update every item in the segment tree every time this happens? How do we handle this? submitted by /u/ImNotKevPlayz [link] [comments]  ( 57 min )

Hi, can it be implemented in the task-level scripts (i.e. ant.py, FrankaCabinet.py etc.) like this? def pre_physics_step(self, actions): ... mask = [1,0,0,0,1] actions = actions * mask This would prevent the computed actions to be applied, but would not "teach" the agent that the masked actions are invalid, right? submitted by /u/Fun-Moose-3841 [link] [comments]  ( 57 min )

In general my understanding of successive halving is this: There are 10 hyperparameter combinations. The program iterates EACH combination for example 15 times and then based on the results chooses the best 5. After this it iterates each of the 5 combinations 30 more times. and until there is one left, so like a tournament style elimination. So how successive halving works is it iterates all of them at once, but in the actual program, optuna iterates the whole of the first hyperparameter combination and then starts randomly pruning and keeping the other combination. Where is the tournament like style?? How can it know to prune the second trial, maybe it will be the second best trial, but it prunes it early just because it is less efficient than the first one. submitted by /u/2kg-Orange [link] [comments]  ( 58 min )

I was trying to learn more about reinforcement learning algorithms and decided to try out SAC for discrete action space. After spending some time trying to adapt SAC to discrete action space, I tried it out on Open AIs gym environment: CartPole-v1. Unfortunately, my algorithm could not find a good policy (as the running average of rewards is somewhere in 20-30 range). I tried double checking my code with the code of others, but can't seam to get it working, thus I am at my wits end. Could someone help me diagnose the problem or tell me what I am doing wrong? Link to the code: https://github.com/simux0072/SAC_D-CartPole-v1 Results from training are in the image. Running loss is calculated as the mean over 100 previous values. https://preview.redd.it/ayf20lqc2b5a1.png?width=1919&format=png&auto=webp&s=60749a1c2202aa00d58d63a36d65c840e3ea0494 PS. I know that SAC should not be used for discrete action space, but later on I will be trying out SAC with HER on a sparse reward discrete action space problem, and thus require an off-policy algorithm, such as SAC. If there are better algorithm to deal with sparse rewards in discrete actions spaces, a suggestion would be appreciated. submitted by /u/DefaltBLK [link] [comments]  ( 57 min )

I've been trying to train my model but it takes an extremely large time to converge on my environment, which is expected since it's a complex one . My question here is if anyone tried to train their own model , what's the expected training time, and would a colab pro package be sufficient to train the model ( in my previous trials to train DDQL model it took more than the 4 hours offered by the free colab ) submitted by /u/Smart_Reward3471 [link] [comments]  ( 63 min )

I'm bucking the trend here but releasing a KNN algorithm that's not in python or pytorch but here it is: KNN algorithm in Lua (Love2d): https://github.com/togfoxy/KNN-machine-learning/tree/main It's my first ever public release of a module so happy to take feedback. submitted by /u/Togfox [link] [comments]  ( 58 min )

Is there a way to get around GPT-3's 4k token limit? Companies like Spellbook appear to have found a solution, with some people speculating what they have done on Twitter - e.g., summarizing the original document, looping in 4k chunks until the right answer is produced, etc. I suspect multiple solutions have been applied. I'd be curious if you have any ideas! Relevant Tweet: https://twitter.com/AlphaMinus2/status/1600319547348639744 submitted by /u/granddaddy [link] [comments]  ( 64 min )

Has Open AI said what ChatGPT's architecture is? What technique is it using to "remember" previous prompts? Have they come up with some way to add recurrence to the transformer or is it just using a feedforward sliding window approach? submitted by /u/029187 [link] [comments]  ( 64 min )

Agile/scrum/waterfall etc', was there something you tried and didn't work? How adjustments that aren't just time extensions to these known methodologies? Im just wondering what other teams do that work, since my team is still trying things out, with a lot of convincing needed for managers/pm who are more pure software oriented. I've found a few references online on how algorithm/ML/datascience development don't fit nicely into agile cycles, but i ended up with more questions. submitted by /u/DisWastingMyTime [link] [comments]  ( 66 min )

Does anyone know of a document editor in which you can dictate text with OpenAI Whisper? Like similar to Google Docs but obviously with fewer features—and not for writing code, just normal text. I would like to use it! ​ I am aware of the HuggingFace Spaces (e.g. https://huggingface.co/spaces/openai/whisper) and Colab notebooks where you can use Whisper, but I don't know of any straight up writing tools. submitted by /u/sidhire [link] [comments]  ( 64 min )

I've been trying to empirically assess what biases ChatGPT has about certain things when I give it minimal information about what I want. The approach that I've tried is to repeatedly make a request in a new thread, look at the distribution of key words, phrases or word/phrase categories across its responses, and compare these distributions across different requests. E.g. one set of requests that I've made have the structure: Make up a realistic story about (a|an) person. Include their name and a description of their appearance. I collected 10 responses for each of the following s: "intelligent", "unintelligent", "devious", "trustworthy", "peaceful", "violent", and did the same for 2 other request structures that request similar information, using the same set of <TRAI…  ( 65 min )

​ https://i.redd.it/nuqdy9e3815a1.gif Hey Reddit, I just wanted to share an art & research project we've been working on that uses AI and reinforcement learning to teach an AI how to sculpt 3D sculptures. It's been really cool to see the AI learn new strategies and adapt to create unique pieces of art and how we as designers start to take on the role of curators. The project started earlier last year after thinking about the future of art and the role of humans in the creative process. Something that seems to be more relevant than ever these days. With AI becoming more advanced, what does that mean for us as creatives? We also wrote about this on the project page. It's an interesting thought and I'd love to hear your thoughts on it. Check out the project here: https://onformative.com/work/ai-sculpting/ and let's discuss in the comments. ​ https://preview.redd.it/ikymqhl7815a1.jpg?width=1280&format=pjpg&auto=webp&s=f375991649ecb3070740471133ddccb6af9e58d4 submitted by /u/onformative [link] [comments]  ( 65 min )

I am working on a multi class sentence pair classification on an highly imbalanced dataset. I have tried different techniques from sampling techniques to focal loss. My question is does it make sense to perform sampling (over or under sampling) while training the model with focal loss? My understanding is that focal loss is geared towards penalising samples that are hard to learn, whereas sampling techniques modifies the distribution of the dataset. So they can be used together. Please share your thoughts. submitted by /u/channel-hopper- [link] [comments]  ( 64 min )

Hi all! I have once read a paper where you could write text and an AI would generate sound design out of it (like; a man walking through grass while birds sing) but I couldn't test it myself. Is there any site where I could test something like this? If you know anything let me know would be great! Thank you so much! X John submitted by /u/johnwireds [link] [comments]  ( 64 min )

Hello everyone! My professor is a reviewer for a conference which is using OpenReview and wants me to complete the reviews on their behalf. I am aware that on CMT, one can officially assign someone else to complete the review on their behalf. I wanted to ask if the same can be done on OpenReview? If yes, I will proceed to ask my professor if they could officially assign the reviews to me. Otherwise, they would upload my reviews but I would not get any credit for it :( Thank you for your response! :) submitted by /u/Fluff269 [link] [comments]  ( 64 min )

Fellow machine learning enthusiast here! I want to train a large NLP model and I'm wondering whether its worth it to use Google Cloud's TPU's for it. I already have an Nvidia RTX 3060 Laptop GPU with 8.76 TFLOPS, but I was unable to find out what the exact performance (in TFLOPS to be able to compare them) of google TPU v3 and v4 are. I know TPUs (I think the factor is 12x) are a ton faster and more optimized for machine learning than GPU's, but I'm still wondering whether its worth it to just build a graphics card rig for the long term. (since the pricing and estimation seems unclear to me since I cannot see how much I'm paying per TFLOP.) Has anyone done the numbers on price/performance and hourly cost? Also is there any factor I missed? Thanks a lot in advance! submitted by /u/Shardsmp [link] [comments]  ( 72 min )

savegpt.com is a browser extension available both on the Chrome webstore and Firefox addons. https://reddit.com/link/zikps2/video/5zinkph4b85a1/player submitted by /u/silentx09 [link] [comments]  ( 65 min )

Hi Folks, Have you tried ChatGPT, GPT-3, or other generative models but have been frustrated by the lack of support or guidance when it comes to using them effectively? Are you interested in learning more about the power of prompt engineering and how it can help you get better results from generative models? We have recently launched a new open-source platform called discuss.openPrompt.io, where you can ask and answer questions, discuss, and share your knowledge and experiences with ChatGPT, Prompt-Engineering, GPT-3, stable diffusion, and other generative models. ​ As many of you may know, ChatGPT was released recently and has generated a lot of excitement among the NLP community. When ChatGPT was released, we were excited to try it out, but we quickly realized that many people are st…  ( 66 min )

submitted by /u/ComprehensiveIce5917 [link] [comments]  ( 45 min )

Can anyone recommend some of the coolest latest AI technology out there for average people like me? For instance midjourney creates computer generated images based off of a text sentence. A website called LALAL can take a song and strip it of vocals to just give you an instrumental version. And then there’s Nvidia canvas which lets you draw very primitive images and it turns it into 3-D landscapes. I’d love to hear other peoples recommendations for cool AI websites/technology they’ve run into this season that can be used to do creative things. submitted by /u/Rachel_reddit_ [link] [comments]  ( 46 min )

I made a novel that talks about the return of the greek gods in the modern world which is a novel that takes the reader through a journey in 42 chapters using only gpt-3 and some Human intervention. https://www.amazon.com/dp/B0BPMKHB2G?fbclid=PAAaYoLa-acoo_O3B-4l5UWsKefDJKbJ3dZrRq1m0H6UAZI9NowBp8VQ2ark0 submitted by /u/youneshlal77 [link] [comments]  ( 45 min )

Most of the time I am reading this book for my AI course in uni I feel like I am learning more terminolgies, definitions instead of actual applications. I don't really understand what makes this book such a popular choice. submitted by /u/Status-Sprinkles1236 [link] [comments]  ( 52 min )

submitted by /u/DropNationalism [link] [comments]  ( 44 min )

submitted by /u/qptbook [link] [comments]  ( 47 min )

One of the human skill that made our species do great things, but also bad ones, is our imagination. From majestics architecture, heartbreaking novels to fantastic art and awesome music, the human always learn the craft diligently, by going trought a trial and error process. You can see an artist do trial and error to compose a new melody, same for a visual artist or for a writer. This "trial and error" process is what make us learn our craft by experiencing the bad and the goods practice, by using our imagination. - What happen to our craft and imagination if we delegate this trial and error process to AI? - How could we still find joy and fulfillment if we are no more in that deep flow state? - Isn't it just in the struggling part that we always manage to push ourselves further, and thanks to our imagination, find new ways to solve that creative problem? - If we entrust the creation, trial and error process to AI, as a basis on which to entrust our creativity, are we still using our imagination, or just working on something AI has made for us? - If we use AI in our creative process, does that mean we are not using our imagination, so, we are no more developing our craft/skill? What's your feedback and opinion on this topic? submitted by /u/crepuscopoli [link] [comments]  ( 47 min )

The primarily used to enhance driver behavior. The main concern of this app to avoid distractions and prevent accidents. Real Word Demo, (3:06) https://youtu.be/cWxfP-F7soY Project Objective Drivooo is developed to assist drivers in real-time. As described earlier, it helps you to avoid distractions and prevent collisions. Moreover, it will utilize the camera of your phone to scan objects and keep drivers following in a lane and warn of potential crashes in real-time. ​ Lane Detection Daytime Socio-Economic Benefits Road Accident is a global problem, in every 2 seconds, an accident happens. According to WHO Approximately 1.3 million people die each year as a result of road traffic crashes. Some modern cars provide the same features as drivooo but they are way too expensive to suppo…  ( 46 min )

I want to add an AI that I trained to all my messaging platform so that my loved ones can still message me from time to time without any suspicions. I plan to move somewhere far before dying. I don't want them to worry. submitted by /u/Safe-Board9430 [link] [comments]  ( 45 min )

Experimenting to see how far I could go with ChatGPT and asked it to write a fiction story of its own creation. Over 62 “chapters” it managed to write an entire novella that is mostly coherent with minimal instruction/correction. It titled this “Emma’s Story.” Chapter 1: A New Beginning The sun was just beginning to rise over the city, casting a warm glow over the streets and buildings. Emma stood at the window of her apartment, watching as the first rays of light peeked over the horizon. She took a deep breath and smiled, feeling a sense of excitement and anticipation for the day ahead. Emma was starting a new chapter in her life. After years of working long hours at a dead-end job, she had finally saved enough money to pursue her dream of becoming a writer. She had always been passiona…  ( 67 min )

A photo I took while at RSS 2022 in New York City, on the dinner cruise arranged by the conference. From June 27 to July 01 this year, I attended the latest the Robotics: Science and Systems conference. This was the first in-person RSS after two virtual editions in 2020 and 2021. I don’t publish in RSS frequently. I only have one RSS paper, VisuoSpatial Foresight, from 2020. I was attending mainly because of its nearby location in New York City and because I was invited to attend RSS Pioneers, which is a unique event arranged by this conference. I’m well aware that this report, like the one I wrote for ICRA 2022, is coming well after the conference has ended. Things have been extremely busy on my end but I will try and improve the turnaround time between attending and reporting about a …  ( 7 min )

submitted by /u/Lakshmireddys [link] [comments]  ( 49 min )

Hi r/neuralnetworks ! I was thinking it would be nice if LLM could remember facts. I thought of a model that could maybe do that. It would be really great if someone could give me a direction. I'm wondering if someone's already worked on this? The model has a "writing" part and a "reading" part. Writing The model receives once sentence at a time from a corpus (Eg. Wikipedia). It also receives its current Cache, which contains a summary of the corpus. The model "writes" something into the cache, like "3 Water is liquid" to put the sentence "Water is liquid" at address 3. Reading The model receives a query asking a question and the cache. It then "reads" at a specific address from the corpus. ​ So if you have a big corpus like: Water (chemical formula H2O) is an inorganic, tra…  ( 49 min )

Geometric equations often involve a determinant with a column of 1s. For example, the equation of a line through two points or a circle through three points Or a general conic section through five points Why all the determinants and why all the 1s? When you see a determinant equal to zero, you immediately think […] Why determinants with columns of ones? first appeared on John D. Cook.  ( 5 min )

As AI-generated text is getting better, it's getting easier to pass it off as human-written. That's not to say it's as good as human-written. Its goal is to sound correct rather than be correct, so it has a well-known tendency to confidently make stuff  ( 4 min )

AI Weirdness: the strange side of machine learning  ( 2 min )

What Is in your opinioni the best course to start with Reinforcement Learning, which Is both hands on and Theoretical? submitted by /u/Emote_del_MP [link] [comments]  ( 58 min )

Hi Everyone, I am quite new in this field of reinforcement learning, I want to learn ans see in practice how these different RL agents work across different environments , I am trying to train the RL agents in Mujoco Environments, but since few days I am finding it quite difficult to install GYM and Mujoco, mujoco has its latest version as "mujoco-2.3.1.post1" and my question is whether OPen AI GYM supports this version, if it does than the error is wierd because the folder that it is trying to look for mujoco bin library is mujoco 210?Can someone advise on that , and do we really need to install mujoco py ? ​ I am very confused though I tried to use the documentation here - openai/mujoco-py: MuJoCo is a physics engine for detailed, efficient rigid body simulations with contacts. mujoco-py allows using MuJoCo from Python 3. (github.com) but its not working out? Can the experts from this community please advise? ​ ​ https://preview.redd.it/sbd4zv9ug55a1.png?width=1343&format=png&auto=webp&s=f6a458a7703a09d4893a5dc93c86a1695143f4fa https://preview.redd.it/hplb20pmg55a1.png?width=1290&format=png&auto=webp&s=dc4a022ad790837d7058d3f1fd42ab17f1c375fc submitted by /u/Affectionate_Fun_836 [link] [comments]  ( 58 min )

For almost a year, I have been working on algorithms using reinforcement learning models to trade on stock market. During the process I went through parts as is data processing, hyper-parameter tuning, live integration, XAI and so much more. I am curious if anyone else here is working on something similar. I would like to see some different approaches to the topic. If you do, you can comment or text me and we can share our thoughts submitted by /u/Apprehensive_Rush314 [link] [comments]  ( 58 min )

Hello, guys! Is there any successor/alternative to retro library that is capable of interacting with any libretro emulation core? I'd like to suggest/help integrating with more "modern" cores (not really modern, but I didn't find any of those libs with PSX cores compatibility, for example). Thanks! Context: I've been into RL for a few months and managed to train an agent for some tasks on a PSX game using socket connections with BizHawk emulator. The problem is: it's slow. Not reaaally slow, but my script is spawning multiple processes of the emulator and there are a lot of things running in them that aren't really necessary for my purpose (also, I think socket isn't the most efficient way to do that, but it seemed to be the most efficient one given the constraint of using that emulator). submitted by /u/victorsevero [link] [comments]  ( 58 min )

Hi, the edited the example codes from Isaac Gym so that the agent only tries to reach the cube on the table. After every episode the cube position and the arm configuration get reset so that the robot can reach the cube at any position from any configuration. The agent can be successfully trained, but I do not why this is working. The reward function says the following things: Each episode consists of 500 simulation steps. And after each step, the distance between the cube and the end-effector is calculated. The smaller the distance the bigger the reward. Now assuming in episode A, the cube is placed at a closer position than in episode B. As the distance to the cube is inherently smaller in episode A, the achievable reward is higher in episode A. But how can the agent learn to reach the cube at any position (incl. in episode B), when the best score from episode A gets never broken? Code Snippets for the reward function: https://github.com/famora2/IsaacGymEnvs/blob/8b6c725a4f46ed349e7bcbfc1b1cb33fefd2bf66/isaacgymenvs/tasks/franka_cube_stack.py#L699 --- Edit: u/New-Resolution3496 ​ https://preview.redd.it/filgig7jj35a1.png?width=842&format=png&auto=webp&s=1fce968152f6155f7320fd35ad06155f2899f240 ​ submitted by /u/Fun-Moose-3841 [link] [comments]  ( 58 min )

I am still very much a noob, been only coding for a year and still trying to break in the field as a Web Developer. Anyways, my math is trash (like basic algebra), my programming is noobish and I want to know what do I need to become good in this field? I really want to someday tackle the problem of making an AI that can beat humans at unsolved board/card games. I have been seeing a lot on Linear Algebra and Statistics, what else do I need? Is Python just the way to go or should I just go with C++? What are good beginner friendly content? Do you guys have any advice for me? submitted by /u/Nimai_TV [link] [comments]  ( 59 min )

Dear friends!! I just wrote my first book! :) It's called "Little Book of Principles" by Homerus Gigas. I used artificial intelligence (ChatGPT) to compile the wisdom of many great thinkers, including Lao Tzu, Epictetus, Marcus Aurelius, and Krishnamurti, into a collection of art and poetry - written in the style of the Tao Te Ching. Then I used StableDiffusion to illustrate the book. I'm not sure if I can post the link to the book here, but would love to get your feedback on the book! It's currently for free on Amazon. submitted by /u/Front_Brain [link] [comments]  ( 44 min )

https://www.youtube.com/watch?v=ck58bVZYKlw submitted by /u/thosiris [link] [comments]  ( 42 min )

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Demo: https://www.youtube.com/watch?v=4oUrm4CnIjo Repo: https://github.com/joshcho/ChatGPT.el submitted by /u/avindroth [link] [comments]  ( 42 min )

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I decided to scratch my own itch and write about things happening in mediatech weekly. (Done it for 3 weeks now) And as there’s an AI boom happening, the content will be generative-AI heavy. Backstory: I’ve been working in tech/media/marketing for years, and for the past couple of years have closely followed what’s happening in generative AI, VR, creative production, design-tech, etc. Everything audiovisual - creating - writing-media essentially. But I’ve never found any newsletter focusing on this broad yet niche topic, so I created my own. There’s just so much exciting stuff happening currently in generative AI (and media in general) that’s worth sharing. I’m trying to capture the biggest announcements every week. This isn’t one of those highly technical, solely Ai newsletters covering everything about the industry in deep nuance. It’s for a broader audience interested in all the cool stuff happening in media. The content varies from week to week. But it includes a couple of longer stories & links to news, or products, or demos, or videos, or papers, etc. Some of the stuff in the last email: ChatGPTs threat to Google and our society 5 Ideas people could build on top of ChatGPT (For example, ads & BS-free recipes. Googling recipes is a torture.) Cool stuff people have used ChatGPT for. European Union spent €400,000 on a metaverse party 5 people attended. World Cup fans using Snapchat filters to stick to display the pride flag at football games. And ofc, Snoop Dobby Dobb (Snoop Dogg X Dobby from Harry Potter) https://preview.redd.it/zxxqkkbne25a1.jpg?width=1170&format=pjpg&auto=webp&s=11eec4b4c22be771b626ac8474abb7eb5650450d If you’re interested in checking it out, there’s a link in the comments. And if you hate me for posting this. Call me a spammer, cast a spell on me, and hold a grudge for the rest of your life. Todaloo! submitted by /u/KCVeske [link] [comments]  ( 46 min )

Like they assume a specific character's attitude, habits, etc. you can talk to them. Like character(dot)AI submitted by /u/Got70TypesOfMalware [link] [comments]  ( 45 min )

If anyone can offer any guidance on problems I'm having with my chatbot, I would be very grateful. The default model is here: https://pytorch.org/tutorials/beginner/chatbot_tutorial.html It is a sequence to sequence RNN encoder-decoder with Gated Recurrent Units (GRU). It uses a greedy search method and a Luong attention layer. My task is to alter it, the project is very open ended. I've decided to try and change it into a "therapist/doctor-Bot". At the moment everything is the same but I'm inputting vastly different datasets to the movie_dialog conversations that were default. Problems: loss: messing with normal parameters (learning rate, number of layers doesn't seem to be helping all that much, can't seem to get the loss 20 words long. At the moment I've limited it to process sentences of 100 words. I can't go too low, the patient doctor conversations are simply very long and if I reduce the sentence length too much I don't have many patient-doctor sentences left to train the model! This is a substantial problem to overcome I feel. The default sentence length was 10, and training was much quicker as a result. Talking to the bot: The main issue appears to be that the bot's response sentence tends to repeat tends to repeat tends to repeat tends to repeat tends to repeat tends to repeat... etc. Just like that, in a single response. Any tips on how to prevent this? It also will repeat the same response to different questions, especially if those questions are short in length. I can't figure out where in code I should attempt to "punish" the bot for doing this. Thanks for reading. submitted by /u/BillMurray2022 [link] [comments]  ( 50 min )

Hi guys, I’m new to Reddit, really looking forward to this. Any tips on how to get the most out of Reddit? Also I’m posting this here cause I’m into AI and if you can suggest some subreddits it would be cool 🙂 cheers let’s go to the moon submitted by /u/Sensitive_Fan_3620 [link] [comments]  ( 42 min )

I am very bad at writing stories as i am too fact oriented and also englisk is not my first language. Using Chad (ChatGPT) we wrote my true story. I told it the plot and the important details. And after about ½ hour we together had written this true story. Chad took my facts and reformulated them also describing the scenery. It even added some details that was true but i did not tell it. I had to hold Chads hand or he wondered of on tangents. But easy to 'nudge' him back on track. Then i used the Colab Notebook from tortoise-tts to train a TEXT2SPEECH model with the voice of a famous narrator where i sampled 3 times 10 sec. speech and used for training. No intention to get the voice to sound like the original narrator but just as an ok human like voice. Added some ambience sounds and this is the result: https://dkcraft.dk/sei/story.mp3 (Length: 5min) I welcome Chad (my name for ChatGPT) as a new tool in my digital toolbox. submitted by /u/sEi_ [link] [comments]  ( 43 min )

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I used Dream! by Wombo submitted by /u/Chase2k7 [link] [comments]  ( 43 min )

I wanna find something that does real time transcription of audio for iOS OtterAI does exactly what I want but I want to find something that doesn't use my recordings to train its AI Any good options? submitted by /u/AviatorPrints [link] [comments]  ( 44 min )

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Paper: Signal Propagation: A Framework for Learning and Inference In a Forward Pass (https://arxiv.org/abs/2204.01723) We introduce the framework for learning with forward passes. I made a friendly and thorough tutorial to learn about and implement forward learning: https://amassivek.github.io/sigprop . The most interesting insights from the framework: This algorithm provides an explanation for how neurons in the brain without error connections receive learning signals. It works for continuous networks with hebbian learning. This provides evidence for this algorithm as model of learning in the brain. It works for spiking neural networks using only the membrane potential (aka voltage in hardware). This supports applying this algorithm for learning on neuromorphic chips. Recent in…  ( 68 min )

Hello everyone. I'm working on a project where a Machine Learning Model (CNN) have to recognize handmade signs on paper cards starting from a camera picture. It's a POC and I don't have the actual pictures, so have to simulate them. Recently I implemented an ImageGenerator to add some noise to a set of images for data augmentation, but this time I don't have any image at all. I have a clean image of the paper card and I created another ImageGenerator to add some random fake signs to that image. I wanted to use the generated images as training set but i was wondering: do I have to create an initial Data Set and use it in every epoch or is it possible to pass different generated images every time? In other words: is it a good thing if the model sees completely different samples every time it start a new epoch? In that case how do I have to handle the evaluation set? Thanks submitted by /u/kaeldric__ [link] [comments]  ( 67 min )

You're interested in modeling the topics of tweets that were initially collected via keyword (hashtag) search. You run an unsupervised topic modeling method (e.g., LDA, BERTopic) and end up with a set of topics that you're reasonably happy with after manual inspection. You now want to deploy this model, but you wonder: what to do when new topics / themes naturally arise? For example, nobody could have predicted covid and you'd certainly like to capture important events like this. So, you need to be able to have new topics. For that, I guess you can retrain on data within a rolling window of, say, 3/6/9 months. However, that will regenerate topics from scratch! You would have to manually inspect the data each time to confirm the new topics are still reasonable. How to deal with this? submitted by /u/TheCockatoo [link] [comments]  ( 66 min )

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Hey guys. We created a small Framework with which you can implement a model of a problem and let the Framework solve it. The Code is pure Java and there is no further need to understand complex mechanisms of Machine Learning. In the repository is a quick example on how this framework plays the game "Snake". For training, it uses a Genetic Algorithm to train Neural Networks. If you can implement Snake in Java you can also use this Framework to let it play your game. The motivation for this Framework was that many people learn Java in school and are interested in Machine Learning, nearly every Framework out there for Machine Learning is written in Python though. This Framework should not be used to make the most complex predictions, it should more get used to implement your first Machine Learning Algorithm in a language most of you are familiar. We try to lure you into the world of Machine Learning! ;) https://github.com/tomLamprecht/AI-Framework Feedback of any kind is very welcomed! :) PS: I'm aware that evolving a Neural Net with Genetic Algorithms is by far not the most efficient way, but I went this road, and I'm going to finish it :D submitted by /u/Lampard557 [link] [comments]  ( 67 min )

As more data move to the cloud and more organizations embrace cloud computing, it is clear that there is a corresponding need to improve cybersecurity strategies. One of the improvements being considered is security-as-code (SaC), which Google has been promoting actively. Many organizations have been supportive of this relatively nascent but promising cybersecurity approach. In… Read More »Security as Code: Creating a New Cybersecurity Paradigm Amid Growing Cloud Use The post Security as Code: Creating a New Cybersecurity Paradigm Amid Growing Cloud Use appeared first on Data Science Central.  ( 21 min )

Heya guys; I’m a high school student who’s low on cash, looking to get started in neural networks, with nothing but some python and a laptop to my name. Any good starter projects for low level, archaic neural networks that aren’t focused on teaching python basics? I bought a book a few years ago about it but it was more on python basics. submitted by /u/StationPhysical [link] [comments]  ( 58 min )

Appearance-based gaze estimation has been very successful with the use of deep learning. Many following works improved domain generalization for gaze estimation. However, even though there has been much progress in domain generalization for gaze estimation, most of the recent work have been focused on cross-dataset performance -- accounting for different distributions in illuminations, head pose, and lighting. Although improving gaze estimation in different distributions of RGB images is important, near-infrared image based gaze estimation is also critical for gaze estimation in dark settings. Also there are inherent limitations relying solely on supervised learning for regression tasks. This paper contributes to solving these problems and proposes GazeCWL, a novel framework for gaze estimation with near-infrared images using contrastive learning. This leverages adversarial attack techniques for data augmentation and a novel contrastive loss function specifically for regression tasks that effectively clusters the features of different samples in the latent space. Our model outperforms previous domain generalization models in infrared image based gaze estimation and outperforms the baseline by 45.6\% while improving the state-of-the-art by 8.6\%, we demonstrate the efficacy of our method.

Federated learning (FL) has gained significant attention recently as a privacy-enhancing tool to jointly train a machine learning model by multiple participants. The prior work on FL has mostly studied how to protect label privacy during model training. However, model evaluation in FL might also lead to potential leakage of private label information. In this work, we propose an evaluation algorithm that can accurately compute the widely used AUC (area under the curve) metric when using the label differential privacy (DP) in FL. Through extensive experiments, we show our algorithms can compute accurate AUCs compared to the ground truth. The code is available at {\url{https://github.com/bytedance/fedlearner/tree/master/example/privacy/DPAUC}}.

Due to the linearity of quantum mechanics, it remains a challenge to design quantum generative machine learning models that embed non-linear activations into the evolution of the statevector. However, some of the most successful classical generative models, such as those based on neural networks, involve highly non-linear dynamics for quality training. In this paper, we explore the effect of these dynamics in quantum generative modeling by introducing a model that adds non-linear activations via a neural network structure onto the standard Born Machine framework - the Quantum Neuron Born Machine (QNBM). To achieve this, we utilize a previously introduced Quantum Neuron subroutine, which is a repeat-until-success circuit with mid-circuit measurements and classical control. After introducing the QNBM, we investigate how its performance depends on network size, by training a 3-layer QNBM with 4 output neurons and various input and hidden layer sizes. We then compare our non-linear QNBM to the linear Quantum Circuit Born Machine (QCBM). We allocate similar time and memory resources to each model, such that the only major difference is the qubit overhead required by the QNBM. With gradient-based training, we show that while both models can easily learn a trivial uniform probability distribution, on a more challenging class of distributions, the QNBM achieves an almost 3x smaller error rate than a QCBM with a similar number of tunable parameters. We therefore provide evidence that suggests that non-linearity is a useful resource in quantum generative models, and we put forth the QNBM as a new model with good generative performance and potential for quantum advantage.

Densely annotating LiDAR point clouds is costly, which restrains the scalability of fully-supervised learning methods. In this work, we study the underexplored semi-supervised learning (SSL) in LiDAR segmentation. Our core idea is to leverage the strong spatial cues of LiDAR point clouds to better exploit unlabeled data. We propose LaserMix to mix laser beams from different LiDAR scans, and then encourage the model to make consistent and confident predictions before and after mixing. Our framework has three appealing properties: 1) Generic: LaserMix is agnostic to LiDAR representations (e.g., range view and voxel), and hence our SSL framework can be universally applied. 2) Statistically grounded: We provide a detailed analysis to theoretically explain the applicability of the proposed framework. 3) Effective: Comprehensive experimental analysis on popular LiDAR segmentation datasets (nuScenes, SemanticKITTI, and ScribbleKITTI) demonstrates our effectiveness and superiority. Notably, we achieve competitive results over fully-supervised counterparts with 2x to 5x fewer labels and improve the supervised-only baseline significantly by 10.8% on average. We hope this concise yet high-performing framework could facilitate future research in semi-supervised LiDAR segmentation. Code is publicly available.

We introduce GAUCHE, a library for GAUssian processes in CHEmistry. Gaussian processes have long been a cornerstone of probabilistic machine learning, affording particular advantages for uncertainty quantification and Bayesian optimisation. Extending Gaussian processes to chemical representations, however, is nontrivial, necessitating kernels defined over structured inputs such as graphs, strings and bit vectors. By defining such kernels in GAUCHE, we seek to open the door to powerful tools for uncertainty quantification and Bayesian optimisation in chemistry. Motivated by scenarios frequently encountered in experimental chemistry, we showcase applications for GAUCHE in molecular discovery and chemical reaction optimisation. The codebase is made available at https://github.com/leojklarner/gauche

Social recommender systems (SocialRS) simultaneously leverage user-to-item interactions as well as user-to-user social relations for the task of generating item recommendations to users. Additionally exploiting social relations is clearly effective in understanding users' tastes due to the effects of homophily and social influence. For this reason, SocialRS has increasingly attracted attention. In particular, with the advance of Graph Neural Networks (GNN), many GNN-based SocialRS methods have been developed recently. Therefore, we conduct a comprehensive and systematic review of the literature on GNN-based SocialRS. In this survey, we first identify 80 papers on GNN-based SocialRS after annotating 2151 papers by following the PRISMA framework (Preferred Reporting Items for Systematic Reviews and Meta-Analysis). Then, we comprehensively review them in terms of their inputs and architectures to propose a novel taxonomy: (1) input taxonomy includes 5 groups of input type notations and 7 groups of input representation notations; (2) architecture taxonomy includes 8 groups of GNN encoder, 2 groups of decoder, and 12 groups of loss function notations. We classify the GNN-based SocialRS methods into several categories as per the taxonomy and describe their details. Furthermore, we summarize the benchmark datasets and metrics widely used to evaluate the GNN-based SocialRS methods. Finally, we conclude this survey by presenting some future research directions.

Bayesian networks (BNs) are a widely used graphical model in machine learning for representing knowledge with uncertainty. The mainstream BN structure learning methods require performing a large number of conditional independence (CI) tests. The learning process is very time-consuming, especially for high-dimensional problems, which hinders the adoption of BNs to more applications. Existing works attempt to accelerate the learning process with parallelism, but face issues including load unbalancing, costly atomic operations and dominant parallel overhead. In this paper, we propose a fast solution named Fast-BNS on multi-core CPUs to enhance the efficiency of the BN structure learning. Fast-BNS is powered by a series of efficiency optimizations including (i) designing a dynamic work pool to monitor the processing of edges and to better schedule the workloads among threads, (ii) grouping the CI tests of the edges with the same endpoints to reduce the number of unnecessary CI tests, (iii) using a cache-friendly data storage to improve the memory efficiency, and (iv) generating the conditioning sets on-the-fly to avoid extra memory consumption. A comprehensive experimental study shows that the sequential version of Fast-BNS is up to 50 times faster than its counterpart, and the parallel version of Fast-BNS achieves 4.8 to 24.5 times speedup over the state-of-the-art multi-threaded solution. Moreover, Fast-BNS has a good scalability to the network size as well as sample size. Fast-BNS source code is freely available at https://github.com/jjiantong/FastBN.

Generalist models, which are capable of performing diverse multi-modal tasks in a task-agnostic way within a single model, have been explored recently. Being, hopefully, an alternative to approaching general-purpose AI, existing generalist models are still at an early stage, where modality and task coverage is limited. To empower multi-modal task-scaling and speed up this line of research, we release a generalist model learning system, OFASys, built on top of a declarative task interface named multi-modal instruction. At the core of OFASys is the idea of decoupling multi-modal task representations from the underlying model implementations. In OFASys, a task involving multiple modalities can be defined declaratively even with just a single line of code. The system automatically generates task plans from such instructions for training and inference. It also facilitates multi-task training for diverse multi-modal workloads. As a starting point, we provide presets of 7 different modalities and 23 highly-diverse example tasks in OFASys, with which we also develop a first-in-kind, single model, OFA+, that can handle text, image, speech, video, and motion data. The single OFA+ model achieves 95% performance in average with only 16% parameters of 15 task-finetuned models, showcasing the performance reliability of multi-modal task-scaling provided by OFASys. Available at https://github.com/OFA-Sys/OFASys

Machine learning driven image-based controllers allow robotic systems to take intelligent actions based on the visual feedback from their environment. Understanding when these controllers might lead to system safety violations is important for their integration in safety-critical applications and engineering corrective safety measures for the system. Existing methods leverage simulation-based testing (or falsification) to find the failures of vision-based controllers, i.e., the visual inputs that lead to closed-loop safety violations. However, these techniques do not scale well to the scenarios involving high-dimensional and complex visual inputs, such as RGB images. In this work, we cast the problem of finding closed-loop vision failures as a Hamilton-Jacobi (HJ) reachability problem. Our approach blends simulation-based analysis with HJ reachability methods to compute an approximation of the backward reachable tube (BRT) of the system, i.e., the set of unsafe states for the system under vision-based controllers. Utilizing the BRT, we can tractably and systematically find the system states and corresponding visual inputs that lead to closed-loop failures. These visual inputs can be subsequently analyzed to find the input characteristics that might have caused the failure. Besides its scalability to high-dimensional visual inputs, an explicit computation of BRT allows the proposed approach to capture non-trivial system failures that are difficult to expose via random simulations. We demonstrate our framework on two case studies involving an RGB image-based neural network controller for (a) autonomous indoor navigation, and (b) autonomous aircraft taxiing.

Deep neural networks have strong capabilities of memorizing the underlying training data, which can be a serious privacy concern. An effective solution to this problem is to train models with differential privacy, which provides rigorous privacy guarantees by injecting random noise to the gradients. This paper focuses on the scenario where sensitive data are distributed among multiple participants, who jointly train a model through federated learning (FL), using both secure multiparty computation (MPC) to ensure the confidentiality of each gradient update, and differential privacy to avoid data leakage in the resulting model. A major challenge in this setting is that common mechanisms for enforcing DP in deep learning, which inject real-valued noise, are fundamentally incompatible with MPC, which exchanges finite-field integers among the participants. Consequently, most existing DP mechanisms require rather high noise levels, leading to poor model utility. Motivated by this, we propose Skellam mixture mechanism (SMM), an approach to enforce DP on models built via FL. Compared to existing methods, SMM eliminates the assumption that the input gradients must be integer-valued, and, thus, reduces the amount of noise injected to preserve DP. Further, SMM allows tight privacy accounting due to the nice composition and sub-sampling properties of the Skellam distribution, which are key to accurate deep learning with DP. The theoretical analysis of SMM is highly non-trivial, especially considering (i) the complicated math of differentially private deep learning in general and (ii) the fact that the mixture of two Skellam distributions is rather complex, and to our knowledge, has not been studied in the DP literature. Extensive experiments on various practical settings demonstrate that SMM consistently and significantly outperforms existing solutions in terms of the utility of the resulting model.

In classic reinforcement learning algorithms, agents make decisions at discrete and fixed time intervals. The physical duration between one decision and the next becomes a critical hyperparameter. When this duration is too short, the agent needs to make many decisions to achieve its goal, aggravating the problem's difficulty. But when this duration is too long, the agent becomes incapable of controlling the system. Physical systems, however, do not need a constant control frequency. For learning agents, it is desirable to operate with low frequency when possible and high frequency when necessary. We propose a framework called Continuous-Time Continuous-Options (CTCO), where the agent chooses options as sub-policies of variable durations. Such options are time-continuous and can interact with the system at any desired frequency providing a smooth change of actions. The empirical analysis shows that our algorithm is competitive w.r.t. other time-abstraction techniques, such as classic option learning and action repetition, and practically overcomes the difficult choice of the decision frequency.

Trajectory prediction is an integral component of modern autonomous systems as it allows for envisioning future intentions of nearby moving agents. Due to the lack of other agents' dynamics and control policies, deep neural network (DNN) models are often employed for trajectory forecasting tasks. Although there exists an extensive literature on improving the accuracy of these models, there is a very limited number of works studying their robustness against adversarially crafted input trajectories. To bridge this gap, in this paper, we propose a targeted adversarial attack against DNN models for trajectory forecasting tasks. We call the proposed attack TA4TP for Targeted adversarial Attack for Trajectory Prediction. Our approach generates adversarial input trajectories that are capable of fooling DNN models into predicting user-specified target/desired trajectories. Our attack relies on solving a nonlinear constrained optimization problem where the objective function captures the deviation of the predicted trajectory from a target one while the constraints model physical requirements that the adversarial input should satisfy. The latter ensures that the inputs look natural and they are safe to execute (e.g., they are close to nominal inputs and away from obstacles). We demonstrate the effectiveness of TA4TP on two state-of-the-art DNN models and two datasets. To the best of our knowledge, we propose the first targeted adversarial attack against DNN models used for trajectory forecasting.

The A* algorithm is commonly used to solve NP-hard combinatorial optimization problems. When provided with a completely informed heuristic function, A* solves many NP-hard minimum-cost path problems in time polynomial in the branching factor and the number of edges in a minimum-cost path. Thus, approximating their completely informed heuristic functions with high precision is NP-hard. We therefore examine recent publications that propose the use of neural networks for this purpose. We support our claim that these approaches do not scale to large instance sizes both theoretically and experimentally. Our first experimental results for three representative NP-hard minimum-cost path problems suggest that using neural networks to approximate completely informed heuristic functions with high precision might result in network sizes that scale exponentially in the instance sizes. The research community might thus benefit from investigating other ways of integrating heuristic search with machine learning.

Modern machine learning models are often constructed taking into account multiple objectives, e.g., to minimize inference time while also maximizing accuracy. Multi-objective hyperparameter optimization (MHPO) algorithms return such candidate models and the approximation of the Pareto front is used to assess their performance. However, when estimating generalization performance of an approximation of a Pareto front found on a validation set by computing the performance of the individual models on the test set, models might no longer be Pareto-optimal. This makes it unclear how to measure performance. To resolve this, we provide a novel evaluation protocol that allows measuring the generalization performance of MHPO methods and to study its capabilities for comparing two optimization experiments.

The classical Weisfeiler-Leman algorithm aka color refinement is fundamental for graph learning with kernels and neural networks. Originally developed for graph isomorphism testing, the algorithm iteratively refines vertex colors. On many datasets, the stable coloring is reached after a few iterations and the optimal number of iterations for machine learning tasks is typically even lower. This suggests that the colors diverge too fast, defining a similarity that is too coarse. We generalize the concept of color refinement and propose a framework for gradual neighborhood refinement, which allows a slower convergence to the stable coloring and thus provides a more fine-grained refinement hierarchy and vertex similarity. We assign new colors by clustering vertex neighborhoods, replacing the original injective color assignment function. Our approach is used to derive new variants of existing graph kernels and to approximate the graph edit distance via optimal assignments regarding vertex similarity. We show that in both tasks, our method outperforms the original color refinement with only a moderate increase in running time advancing the state of the art.

In the field of autonomous robots, reinforcement learning (RL) is an increasingly used method to solve the task of dynamic obstacle avoidance for mobile robots, autonomous ships, and drones. A common practice to train those agents is to use a training environment with random initialization of agent and obstacles. Such approaches might suffer from a low coverage of high-risk scenarios in training, leading to impaired final performance of obstacle avoidance. This paper proposes a general training environment where we gain control over the difficulty of the obstacle avoidance task by using short training episodes and assessing the difficulty by two metrics: The number of obstacles and a collision risk metric. We found that shifting the training towards a greater task difficulty can massively increase the final performance. A baseline agent, using a traditional training environment based on random initialization of agent and obstacles and longer training episodes, leads to a significantly weaker performance. To prove the generalizability of the proposed approach, we designed two realistic use cases: A mobile robot and a maritime ship under the threat of approaching obstacles. In both applications, the previous results can be confirmed, which emphasizes the general usability of the proposed approach, detached from a specific application context and independent of the agent's dynamics. We further added Gaussian noise to the sensor signals, resulting in only a marginal degradation of performance and thus indicating solid robustness of the trained agent.

The ability to learn from human demonstration endows robots with the ability to automate various tasks. However, directly learning from human demonstration is challenging since the structure of the human hand can be very different from the desired robot gripper. In this work, we show that manipulation skills can be transferred from a human to a robot through the use of micro-evolutionary reinforcement learning, where a five-finger human dexterous hand robot gradually evolves into a commercial robot, while repeated interacting in a physics simulator to continuously update the policy that is first learned from human demonstration. To deal with the high dimensions of robot parameters, we propose an algorithm for multi-dimensional evolution path searching that allows joint optimization of both the robot evolution path and the policy. Through experiments on human object manipulation datasets, we show that our framework can efficiently transfer the expert human agent policy trained from human demonstrations in diverse modalities to target commercial robots.

Neural networks have recently allowed solving many ill-posed inverse problems with unprecedented performance. Physics informed approaches already progressively replace carefully hand-crafted reconstruction algorithms in real applications. However, these networks suffer from a major defect: when trained on a given forward operator, they do not generalize well to a different one. The aim of this paper is twofold. First, we show through various applications that training the network with a family of forward operators allows solving the adaptivity problem without compromising the reconstruction quality significantly. Second, we illustrate that this training procedure allows tackling challenging blind inverse problems. Our experiments include partial Fourier sampling problems arising in magnetic resonance imaging (MRI), computerized tomography (CT) and image deblurring.

We construct a universally Bayes consistent learning rule that satisfies differential privacy (DP). We first handle the setting of binary classification and then extend our rule to the more general setting of density estimation (with respect to the total variation metric). The existence of a universally consistent DP learner reveals a stark difference with the distribution-free PAC model. Indeed, in the latter DP learning is extremely limited: even one-dimensional linear classifiers are not privately learnable in this stringent model. Our result thus demonstrates that by allowing the learning rate to depend on the target distribution, one can circumvent the above-mentioned impossibility result and in fact, learn \emph{arbitrary} distributions by a single DP algorithm. As an application, we prove that any VC class can be privately learned in a semi-supervised setting with a near-optimal \emph{labeled} sample complexity of $\tilde{O}(d/\varepsilon)$ labeled examples (and with an unlabeled sample complexity that can depend on the target distribution).

We present a new perspective on loss minimization and the recent notion of Omniprediction through the lens of Outcome Indistingusihability. For a collection of losses and hypothesis class, omniprediction requires that a predictor provide a loss-minimization guarantee simultaneously for every loss in the collection compared to the best (loss-specific) hypothesis in the class. We present a generic template to learn predictors satisfying a guarantee we call Loss Outcome Indistinguishability. For a set of statistical tests--based on a collection of losses and hypothesis class--a predictor is Loss OI if it is indistinguishable (according to the tests) from Nature's true probabilities over outcomes. By design, Loss OI implies omniprediction in a direct and intuitive manner. We simplify Loss OI further, decomposing it into a calibration condition plus multiaccuracy for a class of functions derived from the loss and hypothesis classes. By careful analysis of this class, we give efficient constructions of omnipredictors for interesting classes of loss functions, including non-convex losses. This decomposition highlights the utility of a new multi-group fairness notion that we call calibrated multiaccuracy, which lies in between multiaccuracy and multicalibration. We show that calibrated multiaccuracy implies Loss OI for the important set of convex losses arising from Generalized Linear Models, without requiring full multicalibration. For such losses, we show an equivalence between our computational notion of Loss OI and a geometric notion of indistinguishability, formulated as Pythagorean theorems in the associated Bregman divergence. We give an efficient algorithm for calibrated multiaccuracy with computational complexity comparable to that of multiaccuracy. In all, calibrated multiaccuracy offers an interesting tradeoff point between efficiency and generality in the omniprediction landscape.

The power of Deep Neural Networks (DNNs) depends heavily on the training data quantity, quality and diversity. However, in many real scenarios, it is costly and time-consuming to collect and annotate large-scale data. This has severely hindered the application of DNNs. To address this challenge, we explore a new task of dataset expansion, which seeks to automatically create new labeled samples to expand a small dataset. To this end, we present a Guided Imagination Framework (GIF) that leverages the recently developed big generative models (e.g., DALL-E2) and reconstruction models (e.g., MAE) to "imagine" and create informative new data from seed data to expand small datasets. Specifically, GIF conducts imagination by optimizing the latent features of seed data in a semantically meaningful space, which are fed into the generative models to generate photo-realistic images with new contents. For guiding the imagination towards creating samples useful for model training, we exploit the zero-shot recognition ability of CLIP and introduce three criteria to encourage informative sample generation, i.e., prediction consistency, entropy maximization and diversity promotion. With these essential criteria as guidance, GIF works well for expanding datasets in different domains, leading to 29.9% accuracy gain on average over six natural image datasets, and 12.3% accuracy gain on average over three medical image datasets. The source code will be released: \url{https://github.com/Vanint/DatasetExpansion}.

It is common to address the curse of dimensionality in Markov decision processes (MDPs) by exploiting low-rank representations. This motivates much of the recent theoretical study on linear MDPs. However, most approaches require a given representation under unrealistic assumptions about the normalization of the decomposition or introduce unresolved computational challenges in practice. Instead, we consider an alternative definition of linear MDPs that automatically ensures normalization while allowing efficient representation learning via contrastive estimation. The framework also admits confidence-adjusted index algorithms, enabling an efficient and principled approach to incorporating optimism or pessimism in the face of uncertainty. To the best of our knowledge, this provides the first practical representation learning method for linear MDPs that achieves both strong theoretical guarantees and empirical performance. Theoretically, we prove that the proposed algorithm is sample efficient in both the online and offline settings. Empirically, we demonstrate superior performance over existing state-of-the-art model-based and model-free algorithms on several benchmarks.

In this paper we provide a novel approach to the analysis of kinetic models for label switching, which are used for particle systems that can randomly switch between gradient flows in different energy landscapes. Besides problems in biology and physics, we also demonstrate that stochastic gradient descent, the most popular technique in machine learning, can be understood in this setting, when considering a time-continuous variant. Our analysis is focusing on the case of evolution in a collection of external potentials, for which we provide analytical and numerical results about the evolution as well as the stationary problem.

Adaptive training methods for Physics-informed neural network (PINN) require dedicated constructions of the distribution of weights assigned at each training sample. To efficiently seek such an optimal weight distribution is not a simple task and most existing methods choose the adaptive weights based on approximating the full distribution or the maximum of residuals. In this paper, we show that the bottleneck in the adaptive choice of samples for training efficiency is the behavior of the tail distribution of the numerical residual. Thus, we propose the Residual-Quantile Adjustment (RQA) method for a better weight choice for each training sample. After initially setting the weights proportional to the $p$-th power of the residual, our RQA method reassign all weights above $q$-quantile ($90\%$ for example) to the median value, so that the weight follows a quantile-adjusted distribution derived from the residuals. This iterative reweighting technique, on the other hand, is also very easy to implement. Experiment results show that the proposed method can outperform several adaptive methods on various partial differential equation (PDE) problems.

In equivariant machine learning the idea is to restrict the learning to a hypothesis class where all the functions are equivariant with respect to some group action. Irreducible representations or invariant theory are typically used to parameterize the space of such functions. In this note, we explicate a general procedure, attributed to Malgrange, to express all polynomial maps between linear spaces that are equivariant with respect to the action of a group $G$, given a characterization of the invariant polynomials on a bigger space. The method also parametrizes smooth equivariant maps in the case that $G$ is a compact Lie group.

Recent mean field interpretations of learning dynamics in over-parameterized neural networks offer theoretical insights on the empirical success of first order optimization algorithms in finding global minima of the nonconvex risk landscape. In this paper, we explore applying mean field learning dynamics as a computational algorithm, rather than as an analytical tool. Specifically, we design a Sinkhorn regularized proximal algorithm to approximate the distributional flow from the learning dynamics in the mean field regime over weighted point clouds. In this setting, a contractive fixed point recursion computes the time-varying weights, numerically realizing the interacting Wasserstein gradient flow of the parameter distribution supported over the neuronal ensemble. An appealing aspect of the proposed algorithm is that the measure-valued recursions allow meshless computation. We demonstrate the proposed computational framework of interacting weighted particle evolution on binary and multi-class classification. Our algorithm performs gradient descent of the free energy associated with the risk functional.

Wearable sensor-based human activity recognition (HAR) has emerged as a principal research area and is utilized in a variety of applications. Recently, deep learning-based methods have achieved significant improvement in the HAR field with the development of human-computer interaction applications. However, they are limited to operating in a local neighborhood in the process of a standard convolution neural network, and correlations between different sensors on body positions are ignored. In addition, they still face significant challenging problems with performance degradation due to large gaps in the distribution of training and test data, and behavioral differences between subjects. In this work, we propose a novel Transformer-based Adversarial learning framework for human activity recognition using wearable sensors via Self-KnowledgE Distillation (TASKED), that accounts for individual sensor orientations and spatial and temporal features. The proposed method is capable of learning cross-domain embedding feature representations from multiple subjects datasets using adversarial learning and the maximum mean discrepancy (MMD) regularization to align the data distribution over multiple domains. In the proposed method, we adopt the teacher-free self-knowledge distillation to improve the stability of the training procedure and the performance of human activity recognition. Experimental results show that TASKED not only outperforms state-of-the-art methods on the four real-world public HAR datasets (alone or combined) but also improves the subject generalization effectively.

We present an end-to-end framework to learn partial differential equations that brings together initial data production, selection of boundary conditions, and the use of physics-informed neural operators to solve partial differential equations that are ubiquitous in the study and modeling of physics phenomena. We first demonstrate that our methods reproduce the accuracy and performance of other neural operators published elsewhere in the literature to learn the 1D wave equation and the 1D Burgers equation. Thereafter, we apply our physics-informed neural operators to learn new types of equations, including the 2D Burgers equation in the scalar, inviscid and vector types. Finally, we show that our approach is also applicable to learn the physics of the 2D linear and nonlinear shallow water equations, which involve three coupled partial differential equations. We release our artificial intelligence surrogates and scientific software to produce initial data and boundary conditions to study a broad range of physically motivated scenarios. We provide the source code, an interactive website to visualize the predictions of our physics informed neural operators, and a tutorial for their use at the Data and Learning Hub for Science.

Information-theoretic Bayesian optimization techniques have become popular for optimizing expensive-to-evaluate black-box functions due to their non-myopic qualities. Entropy Search and Predictive Entropy Search both consider the entropy over the optimum in the input space, while the recent Max-value Entropy Search considers the entropy over the optimal value in the output space. We propose Joint Entropy Search (JES), a novel information-theoretic acquisition function that considers an entirely new quantity, namely the entropy over the joint optimal probability density over both input and output space. To incorporate this information, we consider the reduction in entropy from conditioning on fantasized optimal input/output pairs. The resulting approach primarily relies on standard GP machinery and removes complex approximations typically associated with information-theoretic methods. With minimal computational overhead, JES shows superior decision-making, and yields state-of-the-art performance for information-theoretic approaches across a wide suite of tasks. As a light-weight approach with superior results, JES provides a new go-to acquisition function for Bayesian optimization.

In many real-world problems, the learning agent needs to learn a problem's abstractions and solution simultaneously. However, most such abstractions need to be designed and refined by hand for different problems and domains of application. This paper presents a novel top-down approach for constructing state abstractions while carrying out reinforcement learning. Starting with state variables and a simulator, it presents a novel domain-independent approach for dynamically computing an abstraction based on the dispersion of Q-values in abstract states as the agent continues acting and learning. Extensive empirical evaluation on multiple domains and problems shows that this approach automatically learns abstractions that are finely-tuned to the problem, yield powerful sample efficiency, and result in the RL agent significantly outperforming existing approaches.

Among random sampling methods, Markov Chain Monte Carlo algorithms are foremost. Using a combination of analytical and numerical approaches, we study their convergence properties towards the steady state, within a random walk Metropolis scheme. We show that the deviations from the target steady-state distribution feature a localization transition as a function of the characteristic length of the attempted jumps defining the random walk. This transition changes drastically the error which is introduced by incomplete convergence, and discriminates two regimes where the relaxation mechanism is limited respectively by diffusion and by rejection.

Large text-guided diffusion models, such as DALLE-2, are able to generate stunning photorealistic images given natural language descriptions. While such models are highly flexible, they struggle to understand the composition of certain concepts, such as confusing the attributes of different objects or relations between objects. In this paper, we propose an alternative structured approach for compositional generation using diffusion models. An image is generated by composing a set of diffusion models, with each of them modeling a certain component of the image. To do this, we interpret diffusion models as energy-based models in which the data distributions defined by the energy functions may be explicitly combined. The proposed method can generate scenes at test time that are substantially more complex than those seen in training, composing sentence descriptions, object relations, human facial attributes, and even generalizing to new combinations that are rarely seen in the real world. We further illustrate how our approach may be used to compose pre-trained text-guided diffusion models and generate photorealistic images containing all the details described in the input descriptions, including the binding of certain object attributes that have been shown difficult for DALLE-2. These results point to the effectiveness of the proposed method in promoting structured generalization for visual generation. Project page: https://energy-based-model.github.io/Compositional-Visual-Generation-with-Composable-Diffusion-Models/

Many problems in science and engineering involve optimizing an expensive black-box function over a high-dimensional space. For such black-box optimization (BBO) problems, we typically assume a small budget for online function evaluations, but also often have access to a fixed, offline dataset for pretraining. Prior approaches seek to utilize the offline data to approximate the function or its inverse but are not sufficiently accurate far from the data distribution. We propose BONET, a generative framework for pretraining a novel black-box optimizer using offline datasets. In BONET, we train an autoregressive model on fixed-length trajectories derived from an offline dataset. We design a sampling strategy to synthesize trajectories from offline data using a simple heuristic of rolling out monotonic transitions from low-fidelity to high-fidelity samples. Empirically, we instantiate BONET using a causally masked Transformer and evaluate it on Design-Bench, where we rank the best on average, outperforming state-of-the-art baselines.

Neural compression algorithms are typically based on autoencoders that require specialized encoder and decoder architectures for different data modalities. In this paper, we propose COIN++, a neural compression framework that seamlessly handles a wide range of data modalities. Our approach is based on converting data to implicit neural representations, i.e. neural functions that map coordinates (such as pixel locations) to features (such as RGB values). Then, instead of storing the weights of the implicit neural representation directly, we store modulations applied to a meta-learned base network as a compressed code for the data. We further quantize and entropy code these modulations, leading to large compression gains while reducing encoding time by two orders of magnitude compared to baselines. We empirically demonstrate the feasibility of our method by compressing various data modalities, from images and audio to medical and climate data.

Deep neural networks may easily memorize noisy labels present in real-world data, which degrades their ability to generalize. It is therefore important to track and evaluate the robustness of models against noisy label memorization. We propose a metric, called susceptibility, to gauge such memorization for neural networks. Susceptibility is simple and easy to compute during training. Moreover, it does not require access to ground-truth labels and it only uses unlabeled data. We empirically show the effectiveness of our metric in tracking memorization on various architectures and datasets and provide theoretical insights into the design of the susceptibility metric. Finally, we show through extensive experiments on datasets with synthetic and real-world label noise that one can utilize susceptibility and the overall training accuracy to distinguish models that maintain a low memorization on the training set and generalize well to unseen clean data.

Current state-of-the-art segmentation techniques for ocular images are critically dependent on large-scale annotated datasets, which are labor-intensive to gather and often raise privacy concerns. In this paper, we present a novel framework, called BiOcularGAN, capable of generating synthetic large-scale datasets of photorealistic (visible light and near-infrared) ocular images, together with corresponding segmentation labels to address these issues. At its core, the framework relies on a novel Dual-Branch StyleGAN2 (DB-StyleGAN2) model that facilitates bimodal image generation, and a Semantic Mask Generator (SMG) component that produces semantic annotations by exploiting latent features of the DB-StyleGAN2 model. We evaluate BiOcularGAN through extensive experiments across five diverse ocular datasets and analyze the effects of bimodal data generation on image quality and the produced annotations. Our experimental results show that BiOcularGAN is able to produce high-quality matching bimodal images and annotations (with minimal manual intervention) that can be used to train highly competitive (deep) segmentation models (in a privacy aware-manner) that perform well across multiple real-world datasets. The source code for the BiOcularGAN framework is publicly available at https://github.com/dariant/BiOcularGAN.

Restless multi-armed bandits (RMABs) extend multi-armed bandits to allow for stateful arms, where the state of each arm evolves restlessly with different transitions depending on whether that arm is pulled. Solving RMABs requires information on transition dynamics, which are often unknown upfront. To plan in RMAB settings with unknown transitions, we propose the first online learning algorithm based on the Whittle index policy, using an upper confidence bound (UCB) approach to learn transition dynamics. Specifically, we estimate confidence bounds of the transition probabilities and formulate a bilinear program to compute optimistic Whittle indices using these estimates. Our algorithm, UCWhittle, achieves sublinear $O(H \sqrt{T \log T})$ frequentist regret to solve RMABs with unknown transitions in $T$ episodes with a constant horizon $H$. Empirically, we demonstrate that UCWhittle leverages the structure of RMABs and the Whittle index policy solution to achieve better performance than existing online learning baselines across three domains, including one constructed via sampling from a real-world maternal and childcare dataset.

Health metrics from wrist-worn devices demand an automatic dominant hand prediction to keep an accurate operation. The prediction would improve reliability, enhance the consumer experience, and encourage further development of healthcare applications. This paper aims to evaluate the use of physiological and spatiotemporal context information from a two-hand experiment to predict the wrist placement of a commercial smartwatch. The main contribution is a methodology to obtain an effective model and features from low sample rate physiological sensors and a self-reported context survey. Results show an effective dominant hand prediction using data from a single subject under real-life conditions.

Two-level stochastic optimization formulations have become instrumental in a number of machine learning contexts such as continual learning, neural architecture search, adversarial learning, and hyperparameter tuning. Practical stochastic bilevel optimization problems become challenging in optimization or learning scenarios where the number of variables is high or there are constraints. In this paper, we introduce a bilevel stochastic gradient method for bilevel problems with lower-level constraints. We also present a comprehensive convergence theory that covers all inexact calculations of the adjoint gradient (also called hypergradient) and addresses both the lower-level unconstrained and constrained cases. To promote the use of bilevel optimization in large-scale learning, we introduce a practical bilevel stochastic gradient method (BSG-1) that does not require second-order derivatives and, in the lower-level unconstrained case, dismisses any system solves and matrix-vector products.

In recent years, algorithms and neural architectures based on the Weisfeiler-Leman algorithm, a well-known heuristic for the graph isomorphism problem, have emerged as a powerful tool for machine learning with graphs and relational data. Here, we give a comprehensive overview of the algorithm's use in a machine-learning setting, focusing on the supervised regime. We discuss the theoretical background, show how to use it for supervised graph and node representation learning, discuss recent extensions, and outline the algorithm's connection to (permutation-)equivariant neural architectures. Moreover, we give an overview of current applications and future directions to stimulate further research.

Thompson sampling has proven effective across a wide range of stationary bandit environments. However, as we demonstrate in this paper, it can perform poorly when applied to nonstationary environments. We show that such failures are attributed to the fact that, when exploring, the algorithm does not differentiate actions based on how quickly the information acquired loses its usefulness due to nonstationarity. Building upon this insight, we propose predictive sampling, which extends Thompson sampling to do this. We establish a Bayesian regret bound and establish that, in nonstationary bandit environments, the regret incurred by Thompson sampling can far exceed that of predictive sampling. We also present implementations of predictive sampling that scale to complex bandit environments of practical interest in a computationally tractable manner. Through simulations, we demonstrate that predictive sampling outperforms Thompson sampling and other state-of-the-art algorithms across a wide range of nonstationary bandit environments.

Denoising diffusion probabilistic models are a promising new class of generative models that mark a milestone in high-quality image generation. This paper showcases their ability to sequentially generate video, surpassing prior methods in perceptual and probabilistic forecasting metrics. We propose an autoregressive, end-to-end optimized video diffusion model inspired by recent advances in neural video compression. The model successively generates future frames by correcting a deterministic next-frame prediction using a stochastic residual generated by an inverse diffusion process. We compare this approach against five baselines on four datasets involving natural and simulation-based videos. We find significant improvements in terms of perceptual quality for all datasets. Furthermore, by introducing a scalable version of the Continuous Ranked Probability Score (CRPS) applicable to video, we show that our model also outperforms existing approaches in their probabilistic frame forecasting ability.

Recent advances in Named Entity Recognition (NER) show that document-level contexts can significantly improve model performance. In many application scenarios, however, such contexts are not available. In this paper, we propose to find external contexts of a sentence by retrieving and selecting a set of semantically relevant texts through a search engine, with the original sentence as the query. We find empirically that the contextual representations computed on the retrieval-based input view, constructed through the concatenation of a sentence and its external contexts, can achieve significantly improved performance compared to the original input view based only on the sentence. Furthermore, we can improve the model performance of both input views by Cooperative Learning, a training method that encourages the two input views to produce similar contextual representations or output label distributions. Experiments show that our approach can achieve new state-of-the-art performance on 8 NER data sets across 5 domains.

This paper explores a better prediction target for BERT pre-training of vision transformers. We observe that current prediction targets disagree with human perception judgment.This contradiction motivates us to learn a perceptual prediction target. We argue that perceptually similar images should stay close to each other in the prediction target space. We surprisingly find one simple yet effective idea: enforcing perceptual similarity during the dVAE training. Moreover, we adopt a self-supervised transformer model for deep feature extraction and show that it works well for calculating perceptual similarity.We demonstrate that such learned visual tokens indeed exhibit better semantic meanings, and help pre-training achieve superior transfer performance in various downstream tasks. For example, we achieve $\textbf{84.5\%}$ Top-1 accuracy on ImageNet-1K with ViT-B backbone, outperforming the competitive method BEiT by $\textbf{+1.3\%}$ under the same pre-training epochs. Our approach also gets significant improvement on object detection and segmentation on COCO and semantic segmentation on ADE20K. Equipped with a larger backbone ViT-H, we achieve the state-of-the-art ImageNet accuracy (\textbf{88.3\%}) among methods using only ImageNet-1K data.

Incidental supervision from language has become a popular approach for learning generic visual representations that can be prompted to perform many recognition tasks in computer vision. We conduct an in-depth exploration of the CLIP model and show that its visual representation is often strongly biased towards solving some tasks more than others. Moreover, which task the representation will be biased towards is unpredictable, with little consistency across images. To resolve this task bias, we show how to learn a visual prompt that guides the representation towards features relevant to their task of interest. Our results show that these visual prompts can be independent of the input image and still effectively provide a conditioning mechanism to steer visual representations towards the desired task.

Weather forecasting centers currently rely on statistical postprocessing methods to minimize forecast error. This improves skill but can lead to predictions that violate physical principles or disregard dependencies between variables, which can be problematic for downstream applications and for the trustworthiness of postprocessing models, especially when they are based on new machine learning approaches. Building on recent advances in physics-informed machine learning, we propose to achieve physical consistency in deep learning-based postprocessing models by integrating meteorological expertise in the form of analytic equations. Applied to the post-processing of surface weather in Switzerland, we find that constraining a neural network to enforce thermodynamic state equations yields physically-consistent predictions of temperature and humidity without compromising performance. Our approach is especially advantageous when data is scarce, and our findings suggest that incorporating domain expertise into postprocessing models allows to optimize weather forecast information while satisfying application-specific requirements.

Embedded and personal IoT devices are powered by microcontroller units (MCUs), whose extreme resource scarcity is a major obstacle for applications relying on on-device deep learning inference. Orders of magnitude less storage, memory and computational capacity, compared to what is typically required to execute neural networks, impose strict structural constraints on the network architecture and call for specialist model compression methodology. In this work, we present a differentiable structured network pruning method for convolutional neural networks, which integrates a model's MCU-specific resource usage and parameter importance feedback to obtain highly compressed yet accurate classification models. Our methodology (a) improves key resource usage of models up to 80x; (b) prunes iteratively while a model is trained, resulting in little to no overhead or even improved training time; (c) produces compressed models with matching or improved resource usage up to 1.4x in less time compared to prior MCU-specific methods. Compressed models are available for download.

This paper proposes a novel approach to explain the predictions made by data-driven methods. Since such predictions rely heavily on the data used for training, explanations that convey information about how the training data affects the predictions are useful. The paper proposes a novel approach to quantify how different data-clusters of the training data affect a prediction. The quantification is based on Shapley values, a concept which originates from coalitional game theory, developed to fairly distribute the payout among a set of cooperating players. A player's Shapley value is a measure of that player's contribution. Shapley values are often used to quantify feature importance, ie. how features affect a prediction. This paper extends this to cluster importance, letting clusters of the training data act as players in a game where the predictions are the payouts. The novel methodology proposed in this paper lets us explore and investigate how different clusters of the training data affect the predictions made by any black-box model, allowing new aspects of the reasoning and inner workings of a prediction model to be conveyed to the users. The methodology is fundamentally different from existing explanation methods, providing insight which would not be available otherwise, and should complement existing explanation methods, including explanations based on feature importance.

To build general robotic agents that can operate in many environments, it is often imperative for the robot to collect experience in the real world. However, this is often not feasible due to safety, time, and hardware restrictions. We thus propose leveraging the next best thing as real-world experience: internet videos of humans using their hands. Visual priors, such as visual features, are often learned from videos, but we believe that more information from videos can be utilized as a stronger prior. We build a learning algorithm, VideoDex, that leverages visual, action, and physical priors from human video datasets to guide robot behavior. These actions and physical priors in the neural network dictate the typical human behavior for a particular robot task. We test our approach on a robot arm and dexterous hand-based system and show strong results on various manipulation tasks, outperforming various state-of-the-art methods. Videos at https://video-dex.github.io

Knowledge graph (KG) is used to represent data in terms of entities and structural relations between the entities. This representation can be used to solve complex problems such as recommendation systems and question answering. In this study, a set of candidate drugs for COVID-19 are proposed by using Drug repurposing knowledge graph (DRKG). DRKG is a biological knowledge graph constructed using a vast amount of open source biomedical knowledge to understand the mechanism of compounds and the related biological functions. Node and relation embeddings are learned using knowledge graph embedding models and neural network and attention related models. Different models are used to get the node embedding by changing the objective of the model. These embeddings are later used to predict if a candidate drug is effective to treat a disease or how likely it is for a drug to bind to a protein associated to a disease which can be modelled as a link prediction task between two nodes. RESCAL performed the best on the test dataset in terms of MR, MRR and Hits@3.

Determining changes in global temperature and precipitation that may indicate climate change is complicated by annual variations. One approach for finding potential climate change indicators is to train a model that predicts the year from annual means of global temperatures and precipitations. Such data is available from the CMIP6 ensemble of simulations. Here a two-hidden-layer neural network trained on this data successfully predicts the year. Differences among temperature and precipitation patterns for which the model predicts specific years reveal changes through time. To find these optimal patterns, a new way of interpreting what the neural network has learned is explored. Alopex, a stochastic correlative learning algorithm, is used to find optimal temperature and precipitation maps that best predict a given year. These maps are compared over multiple years to show how temperature and precipitations patterns indicative of each year change over time.

Robust prediction of citywide traffic flows at different time periods plays a crucial role in intelligent transportation systems. While previous work has made great efforts to model spatio-temporal correlations, existing methods still suffer from two key limitations: i) Most models collectively predict all regions' flows without accounting for spatial heterogeneity, i.e., different regions may have skewed traffic flow distributions. ii) These models fail to capture the temporal heterogeneity induced by time-varying traffic patterns, as they typically model temporal correlations with a shared parameterized space for all time periods. To tackle these challenges, we propose a novel Spatio-Temporal Self-Supervised Learning (ST-SSL) traffic prediction framework which enhances the traffic pattern representations to be reflective of both spatial and temporal heterogeneity, with auxiliary self-supervised learning paradigms. Specifically, our ST-SSL is built over an integrated module with temporal and spatial convolutions for encoding the information across space and time. To achieve the adaptive spatio-temporal self-supervised learning, our ST-SSL first performs the adaptive augmentation over the traffic flow graph data at both attribute- and structure-levels. On top of the augmented traffic graph, two SSL auxiliary tasks are constructed to supplement the main traffic prediction task with spatial and temporal heterogeneity-aware augmentation. Experiments on four benchmark datasets demonstrate that ST-SSL consistently outperforms various state-of-the-art baselines. Since spatio-temporal heterogeneity widely exists in practical datasets, the proposed framework may also cast light on other spatial-temporal applications. Model implementation is available at https://github.com/Echo-Ji/ST-SSL.

While generative models produce high-quality images of concepts learned from a large-scale database, a user often wishes to synthesize instantiations of their own concepts (for example, their family, pets, or items). Can we teach a model to quickly acquire a new concept, given a few examples? Furthermore, can we compose multiple new concepts together? We propose Custom Diffusion, an efficient method for augmenting existing text-to-image models. We find that only optimizing a few parameters in the text-to-image conditioning mechanism is sufficiently powerful to represent new concepts while enabling fast tuning (~6 minutes). Additionally, we can jointly train for multiple concepts or combine multiple fine-tuned models into one via closed-form constrained optimization. Our fine-tuned model generates variations of multiple, new concepts and seamlessly composes them with existing concepts in novel settings. Our method outperforms several baselines and concurrent works, regarding both qualitative and quantitative evaluations, while being memory and computationally efficient.

This work presents a physics-informed deep learning-based super-resolution framework to enhance the spatio-temporal resolution of the solution of time-dependent partial differential equations (PDE). Prior works on deep learning-based super-resolution models have shown promise in accelerating engineering design by reducing the computational expense of traditional numerical schemes. However, these models heavily rely on the availability of high-resolution (HR) labeled data needed during training. In this work, we propose a physics-informed deep learning-based framework to enhance the spatial and temporal resolution of coarse-scale (both in space and time) PDE solutions without requiring any HR data. The framework consists of two trainable modules independently super-resolving the PDE solution, first in spatial and then in temporal direction. The physics based losses are implemented in a novel way to ensure tight coupling between the spatio-temporally refined outputs at different times and improve framework accuracy. We analyze the capability of the developed framework by investigating its performance on an elastodynamics problem. It is observed that the proposed framework can successfully super-resolve (both in space and time) the low-resolution PDE solutions while satisfying physics-based constraints and yielding high accuracy. Furthermore, the analysis and obtained speed-up show that the proposed framework is well-suited for integration with traditional numerical methods to reduce computational complexity during engineering design.

Variational autoencoders (VAEs) are one class of generative probabilistic latent-variable models designed for inference based on known data. We develop three variations on VAEs by introducing a second parameterized encoder/decoder pair and, for one variation, an additional fixed encoder. The parameters of the encoders/decoders are to be learned with a neural network. The fixed encoder is obtained by probabilistic-PCA. The variations are compared to the Evidence Lower Bound (ELBO) approximation to the original VAE. One variation leads to an Evidence Upper Bound (EUBO) that can be used in conjunction with the original ELBO to interrogate the convergence of the VAE.

We develop a distributed Block Chebyshev-Davidson algorithm to solve large-scale leading eigenvalue problems for spectral analysis in spectral clustering. First, the efficiency of the Chebyshev-Davidson algorithm relies on the prior knowledge of the eigenvalue spectrum, which could be expensive to estimate. This issue can be lessened by the analytic spectrum estimation of the Laplacian or normalized Laplacian matrices in spectral clustering, making the proposed algorithm very efficient for spectral clustering. Second, to make the proposed algorithm capable of analyzing big data, a distributed and parallel version has been developed with attractive scalability. The speedup by parallel computing is approximately equivalent to $\sqrt{p}$, where $p$ denotes the number of processes. Numerical results will be provided to demonstrate its efficiency and advantage over existing algorithms in both sequential and parallel computing.

Modern deep learning models are over-parameterized, where the optimization setup strongly affects the generalization performance. A key element of reliable optimization for these systems is the modification of the loss function. Sharpness-Aware Minimization (SAM) modifies the underlying loss function to guide descent methods towards flatter minima, which arguably have better generalization abilities. In this paper, we focus on a variant of SAM known as mSAM, which, during training, averages the updates generated by adversarial perturbations across several disjoint shards of a mini-batch. Recent work suggests that mSAM can outperform SAM in terms of test accuracy. However, a comprehensive empirical study of mSAM is missing from the literature -- previous results have mostly been limited to specific architectures and datasets. To that end, this paper presents a thorough empirical evaluation of mSAM on various tasks and datasets. We provide a flexible implementation of mSAM and compare the generalization performance of mSAM to the performance of SAM and vanilla training on different image classification and natural language processing tasks. We also conduct careful experiments to understand the computational cost of training with mSAM, its sensitivity to hyperparameters and its correlation with the flatness of the loss landscape. Our analysis reveals that mSAM yields superior generalization performance and flatter minima, compared to SAM, across a wide range of tasks without significantly increasing computational costs.

Whether based on models, training data or a combination, classifiers place (possibly complex) input data into one of a relatively small number of output categories. In this paper, we study the structure of the boundary--those points for which a neighbor is classified differently--in the context of an input space that is a graph, so that there is a concept of neighboring inputs, The scientific setting is a model-based naive Bayes classifier for DNA reads produced by Next Generation Sequencers. We show that the boundary is both large and complicated in structure. We create a new measure of uncertainty, called Neighbor Similarity, that compares the result for a point to the distribution of results for its neighbors. This measure not only tracks two inherent uncertainty measures for the Bayes classifier, but also can be implemented, at a computational cost, for classifiers without inherent measures of uncertainty.

Data-efficient learning on graphs (GEL) is essential in real-world applications. Existing GEL methods focus on learning useful representations for nodes, edges, or entire graphs with ``small'' labeled data. But the problem of data-efficient learning for subgraph prediction has not been explored. The challenges of this problem lie in the following aspects: 1) It is crucial for subgraphs to learn positional features to acquire structural information in the base graph in which they exist. Although the existing subgraph neural network method is capable of learning disentangled position encodings, the overall computational complexity is very high. 2) Prevailing graph augmentation methods for GEL, including rule-based, sample-based, adaptive, and automated methods, are not suitable for augmenting subgraphs because a subgraph contains fewer nodes but richer information such as position, neighbor, and structure. Subgraph augmentation is more susceptible to undesirable perturbations. 3) Only a small number of nodes in the base graph are contained in subgraphs, which leads to a potential ``bias'' problem that the subgraph representation learning is dominated by these ``hot'' nodes. By contrast, the remaining nodes fail to be fully learned, which reduces the generalization ability of subgraph representation learning. In this paper, we aim to address the challenges above and propose a Position-Aware Data-Efficient Learning framework for subgraph neural networks called PADEL. Specifically, we propose a novel node position encoding method that is anchor-free, and design a new generative subgraph augmentation method based on a diffused variational subgraph autoencoder, and we propose exploratory and exploitable views for subgraph contrastive learning. Extensive experiment results on three real-world datasets show the superiority of our proposed method over state-of-the-art baselines.

One of the weaknesses of classical (fuzzy) rough sets is their sensitivity to noise, which is particularly undesirable for machine learning applications. One approach to solve this issue is by making use of fuzzy quantifiers, as done by the vaguely quantified fuzzy rough set (VQFRS) model. While this idea is intuitive, the VQFRS model suffers from both theoretical flaws as well as from suboptimal performance in applications. In this paper, we improve on VQFRS by introducing fuzzy quantifier-based fuzzy rough sets (FQFRS), an intuitive generalization of fuzzy rough sets that makes use of general unary and binary quantification models. We show how several existing models fit in this generalization as well as how it inspires novel ones. Several binary quantification models are proposed to be used with FQFRS. We conduct a theoretical study of their properties, and investigate their potential by applying them to classification problems. In particular, we highlight Yager's Weighted Implication-based (YWI) binary quantification model, which induces a fuzzy rough set model that is both a significant improvement on VQFRS, as well as a worthy competitor to the popular ordered weighted averaging based fuzzy rough set (OWAFRS) model.

We study the capabilities of speech processing systems trained simply to predict large amounts of transcripts of audio on the internet. When scaled to 680,000 hours of multilingual and multitask supervision, the resulting models generalize well to standard benchmarks and are often competitive with prior fully supervised results but in a zero-shot transfer setting without the need for any fine-tuning. When compared to humans, the models approach their accuracy and robustness. We are releasing models and inference code to serve as a foundation for further work on robust speech processing.

Ordinary Deep Learning models require having the dimension of their outputs determined by a human practitioner prior to training and operation. For design tasks, this places a hard limit on the maximum complexity of any designs produced by a neural network, which is disadvantageous if a greater allowance for complexity would result in better designs. In this paper, we introduce a methodology for taking outputs of non-finite dimension from neural networks, by learning a "neural waveform," and then taking as outputs the coefficients of its Fourier series representation. We then present experimental evidence that neural networks can learn in this setting on a toy problem.

The fifth generation of the Radio Access Network (RAN) has brought new services, technologies, and paradigms with the corresponding societal benefits. However, the energy consumption of 5G networks is today a concern. In recent years, the design of new methods for decreasing the RAN power consumption has attracted interest from both the research community and standardization bodies, and many energy savings solutions have been proposed. However, there is still a need to understand the power consumption behavior of state-ofthe-art base station architectures, such as multi-carrier active antenna units (AAUs), as well as the impact of different network parameters. In this paper, we present a power consumption model for 5G AAUs based on artificial neural networks. We demonstrate that this model achieves good estimation performance, and it is able to capture the benefits of energy saving when dealing with the complexity of multi-carrier base stations architectures. Importantly, multiple experiments are carried out to show the advantage of designing a general model able to capture the power consumption behaviors of different types of AAUs. Finally, we provide an analysis of the model scalability and the training data requirements.

Large machine learning models with improved predictions have become widely available in the chemical sciences. Unfortunately, these models do not protect the privacy necessary within commercial settings, prohibiting the use of potentially extremely valuable data by others. Encrypting the prediction process can solve this problem by double-blind model evaluation and prohibits the extraction of training or query data. However, contemporary ML models based on fully homomorphic encryption or federated learning are either too expensive for practical use or have to trade higher speed for weaker security. We have implemented secure and computationally feasible encrypted machine learning models using oblivious transfer enabling and secure predictions of molecular quantum properties across chemical compound space. However, we find that encrypted predictions using kernel ridge regression models are a million times more expensive than without encryption. This demonstrates a dire need for a compact machine learning model architecture, including molecular representation and kernel matrix size, that minimizes model evaluation costs.

This paper addresses the problem of reliably and efficiently solving broad classes of long-horizon stochastic path planning problems. Starting with a vanilla RL formulation with a stochastic dynamics simulator and an occupancy matrix of the environment, our approach computes useful options with policies as well as high-level paths that compose the discovered options. Our main contributions are (1) data-driven methods for creating abstract states that serve as endpoints for helpful options, (2) methods for computing option policies using auto-generated option guides in the form of dense pseudo-reward functions, and (3) an overarching algorithm for composing the computed options. We show that this approach yields strong guarantees of executability and solvability: under fairly general conditions, the computed option guides lead to composable option policies and consequently ensure downward refinability. Empirical evaluation on a range of robots, environments, and tasks shows that this approach effectively transfers knowledge across related tasks and that it outperforms existing approaches by a significant margin.

Transfer learning is a simple and powerful method that can be used to boost model performance of low-resource neural machine translation (NMT). Existing transfer learning methods for NMT are static, which simply transfer knowledge from a parent model to a child model once via parameter initialization. In this paper, we propose a novel transfer learning method for NMT, namely ConsistTL, which can continuously transfer knowledge from the parent model during the training of the child model. Specifically, for each training instance of the child model, ConsistTL constructs the semantically-equivalent instance for the parent model and encourages prediction consistency between the parent and child for this instance, which is equivalent to the child model learning each instance under the guidance of the parent model. Experimental results on five low-resource NMT tasks demonstrate that ConsistTL results in significant improvements over strong transfer learning baselines, with a gain up to 1.7 BLEU over the existing back-translation model on the widely-used WMT17 Turkish-English benchmark. Further analysis reveals that ConsistTL can improve the inference calibration of the child model. Code and scripts are freely available at https://github.com/NLP2CT/ConsistTL.

Inverse medium scattering solvers generally reconstruct a single solution without an associated measure of uncertainty. This is true both for the classical iterative solvers and for the emerging deep learning methods. But ill-posedness and noise can make this single estimate inaccurate or misleading. While deep networks such as conditional normalizing flows can be used to sample posteriors in inverse problems, they often yield low-quality samples and uncertainty estimates. In this paper, we propose U-Flow, a Bayesian U-Net based on conditional normalizing flows, which generates high-quality posterior samples and estimates physically-meaningful uncertainty. We show that the proposed model significantly outperforms the recent normalizing flows in terms of posterior sample quality while having comparable performance with the U-Net in point estimation.

The rapidly increasing number of internet of things (IoT) and non-IoT devices has imposed new security challenges to network administrators. Accurate device identification in the increasingly complex network structures is necessary. In this paper, a device fingerprinting (DFP) method has been proposed for device identification, based on digital footprints, which devices use for communication over a network. A subset of nine features have been selected from the network and transport layers of a single transmission control protocol/internet protocol packet based on attribute evaluators in Weka, to generate device-specific signatures. The method has been evaluated on two online datasets, and an experimental dataset, using different supervised machine learning (ML) algorithms. Results have shown that the method is able to distinguish device type with up to 100% precision using the random forest (RF) classifier, and classify individual devices with up to 95.7% precision. These results demonstrate the applicability of the proposed DFP method for device identification, in order to provide a more secure and robust network.

A large portion of today's world population suffer from vision impairments and wear prescription eyeglasses. However, eyeglasses causes additional bulk and discomfort when used with augmented and virtual reality headsets, thereby negatively impacting the viewer's visual experience. In this work, we remedy the usage of prescription eyeglasses in Virtual Reality (VR) headsets by shifting the optical complexity completely into software and propose a prescription-aware rendering approach for providing sharper and immersive VR imagery. To this end, we develop a differentiable display and visual perception model encapsulating display-specific parameters, color and visual acuity of human visual system and the user-specific refractive errors. Using this differentiable visual perception model, we optimize the rendered imagery in the display using stochastic gradient-descent solvers. This way, we provide prescription glasses-free sharper images for a person with vision impairments. We evaluate our approach on various displays, including desktops and VR headsets, and show significant quality and contrast improvements for users with vision impairments.

Performing data-intensive tasks in the von Neumann architecture is challenging to achieve both high performance and power efficiency due to the memory wall bottleneck. Computing-in-memory (CiM) is a promising mitigation approach by enabling parallel in-situ multiply-accumulate (MAC) operations within the memory with support from the peripheral interface and datapath. SRAM-based charge-domain CiM (CD-CiM) has shown its potential of enhanced power efficiency and computing accuracy. However, existing SRAM-based CD-CiM faces scaling challenges to meet the throughput requirement of high-performance multi-bit-quantization applications. This paper presents an SRAM-based high-throughput ReLU-optimized CD-CiM macro. It is capable of completing MAC and ReLU of two signed 8b vectors in one CiM cycle with only one A/D conversion. Along with non-linearity compensation for the analog computing and A/D conversion interfaces, this work achieves 51.2GOPS throughput and 10.3TOPS/W energy efficiency, while showing 88.6% accuracy in the CIFAR-10 dataset.

The widespread of false information is a rising concern worldwide with critical social impact, inspiring the emergence of fact-checking organizations to mitigate misinformation dissemination. However, human-driven verification leads to a time-consuming task and a bottleneck to have checked trustworthy information at the same pace they emerge. Since misinformation relates not only to the content itself but also to other social features, this paper addresses automatic misinformation checking in social networks from a multimodal perspective. Moreover, as simply naming a piece of news as incorrect may not convince the citizen and, even worse, strengthen confirmation bias, the proposal is a modality-level explainable-prone misinformation classifier framework. Our framework comprises a misinformation classifier assisted by explainable methods to generate modality-oriented explainable inferences. Preliminary findings show that the misinformation classifier does benefit from multimodal information encoding and the modality-oriented explainable mechanism increases both inferences' interpretability and completeness.

Counterfactuals are often described as 'retrospective,' focusing on hypothetical alternatives to a realized past. This description relates to an often implicit assumption about the structure and stability of exogenous variables in the system being modeled -- an assumption that is reasonable in many settings where counterfactuals are used. In this work, we consider cases where we might reasonably make a different assumption about exogenous variables, namely, that the exogenous noise terms of each unit do exhibit some unit-specific structure and/or stability. This leads us to a different use of counterfactuals -- a 'forward-looking' rather than 'retrospective' counterfactual. We introduce "counterfactual treatment choice," a type of treatment choice problem that motivates using forward-looking counterfactuals. We then explore how mismatches between interventional versus forward-looking counterfactual approaches to treatment choice, consistent with different assumptions about exogenous noise, can lead to counterintuitive results.

Privacy-preserving inference via edge or encrypted computing paradigms encourages users of machine learning services to confidentially run a model on their personal data for a target task and only share the model's outputs with the service provider; e.g., to activate further services. Nevertheless, despite all confidentiality efforts, we show that a ''vicious'' service provider can approximately reconstruct its users' personal data by observing only the model's outputs, while keeping the target utility of the model very close to that of a ''honest'' service provider. We show the possibility of jointly training a target model (to be run at users' side) and an attack model for data reconstruction (to be secretly used at server's side). We introduce the ''reconstruction risk'': a new measure for assessing the quality of reconstructed data that better captures the privacy risk of such attacks. Experimental results on 6 benchmark datasets show that for low-complexity data types, or for tasks with larger number of classes, a user's personal data can be approximately reconstructed from the outputs of a single target inference task. We propose a potential defense mechanism that helps to distinguish vicious vs. honest classifiers at inference time. We conclude this paper by discussing current challenges and open directions for future studies. We open-source our code and results, as a benchmark for future work.

Unsupervised source-free domain adaptation methods aim to train a model to be used in the target domain utilizing the pretrained source-domain model and unlabeled target-domain data, where the source data may not be accessible due to intellectual property or privacy issues. These methods frequently utilize self-training with pseudo-labeling thresholded by prediction confidence. In a source-free scenario, only supervision comes from target data, and thresholding limits the contribution of the self-training. In this study, we utilize self-training with a mean-teacher approach. The student network is trained with all predictions of the teacher network. Instead of thresholding the predictions, the gradients calculated from the pseudo-labels are weighted based on the reliability of the teacher's predictions. We propose a novel method that uses proxy-based metric learning to estimate reliability. We train a metric network on the encoder features of the teacher network. Since the teacher is updated with the moving average, the encoder feature space is slowly changing. Therefore, the metric network can be updated in training time, which enables end-to-end training. We also propose a metric-based online ClassMix method to augment the input of the student network where the patches to be mixed are decided based on the metric reliability. We evaluated our method in synthetic-to-real and cross-city scenarios. The benchmarks show that our method significantly outperforms the existing state-of-the-art methods.

The paper addresses the problem of finding the causal direction between two associated variables. The proposed solution is to build an autoencoder of their joint distribution and to maximize its estimation capacity relative to both the marginal distributions. It is shown that the resulting two capacities cannot, in general, be equal. This leads to a new criterion for causal discovery: the higher capacity is consistent with the unconstrained choice of a distribution representing the cause while the lower capacity reflects the constraints imposed by the mechanism on the distribution of the effect. Estimation capacity is defined as the ability of the auto-encoder to represent arbitrary datasets. A regularization term forces it to decide which one of the variables to model in a more generic way i.e., while maintaining higher model capacity. The causal direction is revealed by the constraints encountered while encoding the data instead of being measured as a property of the data itself. The idea is implemented and tested using a restricted Boltzmann machine.

There is a growing interest in the use of reduced-precision arithmetic, exacerbated by the recent interest in artificial intelligence, especially with deep learning. Most architectures already provide reduced-precision capabilities (e.g., 8-bit integer, 16-bit floating point). In the context of FPGAs, any number format and bit-width can even be considered.In computer arithmetic, the representation of real numbers is a major issue. Fixed-point (FxP) and floating-point (FlP) are the main options to represent reals, both with their advantages and drawbacks. This chapter presents both FxP and FlP number representations, and draws a fair a comparison between their cost, performance and energy, as well as their impact on accuracy during computations.It is shown that the choice between FxP and FlP is not obvious and strongly depends on the application considered. In some cases, low-precision floating-point arithmetic can be the most effective and provides some benefits over the classical fixed-point choice for energy-constrained applications.

Though graph representation learning (GRL) has made significant progress, it is still a challenge to extract and embed the rich topological structure and feature information in an adequate way. Most existing methods focus on local structure and fail to fully incorporate the global topological structure. To this end, we propose a novel Structure-Preserving Graph Representation Learning (SPGRL) method, to fully capture the structure information of graphs. Specifically, to reduce the uncertainty and misinformation of the original graph, we construct a feature graph as a complementary view via k-Nearest Neighbor method. The feature graph can be used to contrast at node-level to capture the local relation. Besides, we retain the global topological structure information by maximizing the mutual information (MI) of the whole graph and feature embeddings, which is theoretically reduced to exchanging the feature embeddings of the feature and the original graphs to reconstruct themselves. Extensive experiments show that our method has quite superior performance on semi-supervised node classification task and excellent robustness under noise perturbation on graph structure or node features.

Accompanying rapid industrialization, humans are suffering from serious air pollution problems. The demand for air quality prediction is becoming more and more important to the government's policy-making and people's daily life. In this paper, We propose GreenEyes -- a deep neural network model, which consists of a WaveNet-based backbone block for learning representations of sequences and an LSTM with a Temporal Attention module for capturing the hidden interactions between features of multi-channel inputs. To evaluate the effectiveness of our proposed method, we carry out several experiments including an ablation study on our collected and preprocessed air quality data near HKUST. The experimental results show our model can effectively predict the air quality level of the next timestamp given any segment of the air quality data from the data set. We have also released our standalone dataset at https://github.com/AI-Huang/IAQI_Dataset The model and code for this paper are publicly available at https://github.com/AI-Huang/AirEvaluation

The input and output of most text generation tasks can be transformed to two sequences of tokens and they can be modeled using sequence-to-sequence learning modeling tools such as Transformers. These models are usually trained by maximizing the likelihood the output text sequence and assumes the input sequence and all gold preceding tokens are given during training, while during inference the model suffers from the exposure bias problem (i.e., it only has access to its previously predicted tokens rather gold tokens during beam search). In this paper, we propose MoCa ({\bf Mo}mentum {\bf Ca}libration) for text generation. MoCa is an online method that dynamically generates slowly evolving (but consistent) samples using a momentum moving average generator with beam search and MoCa learns to align its model scores of these samples with their actual qualities. Experiments on four text generation datasets (i.e., CNN/DailyMail, XSum, SAMSum and Gigaword) show MoCa consistently improves strong pre-trained transformers using vanilla fine-tuning and we achieve the state-of-the-art results on CNN/DailyMail and SAMSum datasets.

Digital security has been an active area of research interest due to the rapid adaptation of internet infrastructure, the increasing popularity of social media, and digital cameras. Due to inherent differences in working principles to generate an image, different camera brands left behind different intrinsic processing noises which can be used to identify the camera brand. In the last decade, many signal processing and deep learning-based methods have been proposed to identify and isolate this noise from the scene details in an image to detect the source camera brand. One prominent solution is to utilize a hierarchical classification system rather than the traditional single-classifier approach. Different individual networks are used for brand-level and model-level source camera identification. This approach allows for better scaling and requires minimal modifications for adding a new camera brand/model to the solution. However, using different full-fledged networks for both brand and model-level classification substantially increases memory consumption and training complexity. Moreover, extracted low-level features from the different network's initial layers often coincide, resulting in redundant weights. To mitigate the training and memory complexity, we propose a classifier-block-level hierarchical system instead of a network-level one for source camera model classification. Our proposed approach not only results in significantly fewer parameters but also retains the capability to add a new camera model with minimal modification. Thorough experimentation on the publicly available Dresden dataset shows that our proposed approach can achieve the same level of state-of-the-art performance but requires fewer parameters compared to a state-of-the-art network-level hierarchical-based system.

This paper develops a clustering method that takes advantage of the sturdiness of model-based clustering, while attempting to mitigate some of its pitfalls. First, we note that standard model-based clustering likely leads to the same number of clusters per margin, which seems a rather artificial assumption for a variety of datasets. We tackle this issue by specifying a finite mixture model per margin that allows each margin to have a different number of clusters, and then cluster the multivariate data using a strategy game-inspired algorithm to which we call Reign-and-Conquer. Second, since the proposed clustering approach only specifies a model for the margins -- but leaves the joint unspecified -- it has the advantage of being partially parallelizable; hence, the proposed approach is computationally appealing as well as more tractable for moderate to high dimensions than a `full' (joint) model-based clustering approach. A battery of numerical experiments on artificial data indicate an overall good performance of the proposed methods in a variety of scenarios, and real datasets are used to showcase their application in practice.

Out-of-distribution (OOD) detection is a critical task for deploying machine learning models in the open world. Distance-based methods have demonstrated promise, where testing samples are detected as OOD if they are relatively far away from in-distribution (ID) data. However, prior methods impose a strong distributional assumption of the underlying feature space, which may not always hold. In this paper, we explore the efficacy of non-parametric nearest-neighbor distance for OOD detection, which has been largely overlooked in the literature. Unlike prior works, our method does not impose any distributional assumption, hence providing stronger flexibility and generality. We demonstrate the effectiveness of nearest-neighbor-based OOD detection on several benchmarks and establish superior performance. Under the same model trained on ImageNet-1k, our method substantially reduces the false positive rate (FPR@TPR95) by 24.77% compared to a strong baseline SSD+, which uses a parametric approach Mahalanobis distance in detection. Code is available: https://github.com/deeplearning-wisc/knn-ood.

The occurrence of vacuum arcs or radio frequency (rf) breakdowns is one of the most prevalent factors limiting the high-gradient performance of normal conducting rf cavities in particle accelerators. In this paper, we search for the existence of previously unrecognized features related to the incidence of rf breakdowns by applying a machine learning strategy to high-gradient cavity data from CERN's test stand for the Compact Linear Collider (CLIC). By interpreting the parameters of the learned models with explainable artificial intelligence (AI), we reverse-engineer physical properties for deriving fast, reliable, and simple rule-based models. Based on 6 months of historical data and dedicated experiments, our models show fractions of data with a high influence on the occurrence of breakdowns. Specifically, it is shown that the field emitted current following an initial breakdown is closely related to the probability of another breakdown occurring shortly thereafter. Results also indicate that the cavity pressure should be monitored with increased temporal resolution in future experiments, to further explore the vacuum activity associated with breakdowns.

A major direction in differentially private machine learning is differentially private fine-tuning: pretraining a model on a source of "public data" and transferring the extracted features to downstream tasks. This is an important setting because many industry deployments fine-tune publicly available feature extractors on proprietary data for downstream tasks. In this paper, we use features extracted from state-of-the-art open source models to solve benchmark tasks in computer vision and natural language processing using differentially private fine-tuning. Our key insight is that by accelerating training, we can quickly drive the model parameters to regions in parameter space where the impact of noise is minimized. In doing so, we recover the same performance as non-private fine-tuning for realistic values of epsilon in [0.01, 1.0] on benchmark image classification datasets including CIFAR100.

DeeProb-kit is a unified library written in Python consisting of a collection of deep probabilistic models (DPMs) that are tractable and exact representations for the modelled probability distributions. The availability of a representative selection of DPMs in a single library makes it possible to combine them in a straightforward manner, a common practice in deep learning research nowadays. In addition, it includes efficiently implemented learning techniques, inference routines, statistical algorithms, and provides high-quality fully-documented APIs. The development of DeeProb-kit will help the community to accelerate research on DPMs as well as to standardise their evaluation and better understand how they are related based on their expressivity.

In this work, we present a novel framework built to simplify 3D asset generation for amateur users. To enable interactive generation, our method supports a variety of input modalities that can be easily provided by a human, including images, text, partially observed shapes and combinations of these, further allowing to adjust the strength of each input. At the core of our approach is an encoder-decoder, compressing 3D shapes into a compact latent representation, upon which a diffusion model is learned. To enable a variety of multi-modal inputs, we employ task-specific encoders with dropout followed by a cross-attention mechanism. Due to its flexibility, our model naturally supports a variety of tasks, outperforming prior works on shape completion, image-based 3D reconstruction, and text-to-3D. Most interestingly, our model can combine all these tasks into one swiss-army-knife tool, enabling the user to perform shape generation using incomplete shapes, images, and textual descriptions at the same time, providing the relative weights for each input and facilitating interactivity. Despite our approach being shape-only, we further show an efficient method to texture the generated shape using large-scale text-to-image models.

In the presence of noisy labels, designing robust loss functions is critical for securing the generalization performance of deep neural networks. Cross Entropy (CE) loss has been shown to be not robust to noisy labels due to its unboundedness. To alleviate this issue, existing works typically design specialized robust losses with the symmetric condition, which usually lead to the underfitting issue. In this paper, our key idea is to induce a loss bound at the logit level, thus universally enhancing the noise robustness of existing losses. Specifically, we propose logit clipping (LogitClip), which clamps the norm of the logit vector to ensure that it is upper bounded by a constant. In this manner, CE loss equipped with our LogitClip method is effectively bounded, mitigating the overfitting to examples with noisy labels. Moreover, we present theoretical analyses to certify the noise-tolerant ability of LogitClip. Extensive experiments show that LogitClip not only significantly improves the noise robustness of CE loss, but also broadly enhances the generalization performance of popular robust losses.

We propose an analysis-by-synthesis method for fast multi-view 3D reconstruction of opaque objects with arbitrary materials and illumination. State-of-the-art methods use both neural surface representations and neural rendering. While flexible, neural surface representations are a significant bottleneck in optimization runtime. Instead, we represent surfaces as triangle meshes and build a differentiable rendering pipeline around triangle rasterization and neural shading. The renderer is used in a gradient descent optimization where both a triangle mesh and a neural shader are jointly optimized to reproduce the multi-view images. We evaluate our method on a public 3D reconstruction dataset and show that it can match the reconstruction accuracy of traditional baselines and neural approaches while surpassing them in optimization runtime. Additionally, we investigate the shader and find that it learns an interpretable representation of appearance, enabling applications such as 3D material editing.

Recently, RNN-Transducers have achieved remarkable results on various automatic speech recognition tasks. However, lattice-free sequence discriminative training methods, which obtain superior performance in hybrid modes, are rarely investigated in RNN-Transducers. In this work, we propose three lattice-free training objectives, namely lattice-free maximum mutual information, lattice-free segment-level minimum Bayes risk, and lattice-free minimum Bayes risk, which are used for the final posterior output of the phoneme-based neural transducer with a limited context dependency. Compared to criteria using N-best lists, lattice-free methods eliminate the decoding step for hypotheses generation during training, which leads to more efficient training. Experimental results show that lattice-free methods gain up to 6.5% relative improvement in word error rate compared to a sequence-level cross-entropy trained model. Compared to the N-best-list based minimum Bayes risk objectives, lattice-free methods gain 40% - 70% relative training time speedup with a small degradation in performance.

Over-the-air computation has the potential to increase the communication-efficiency of data-dependent distributed wireless systems, but is vulnerable to eavesdropping. We consider over-the-air computation over block-fading additive white Gaussian noise channels in the presence of a passive eavesdropper. The goal is to design a secure over-the-air computation scheme. We propose a scheme that achieves MSE-security against the eavesdropper by employing zero-forced artificial noise, while keeping the distortion at the legitimate receiver small. In contrast to former approaches, the security does not depend on external helper nodes to jam the eavesdropper's receive signal. We thoroughly design the system parameters of the scheme, propose an artificial noise design that harnesses unused transmit power for security, and give an explicit construction rule. Our design approach is applicable both if the eavesdropper's channel coefficients are known and if they are unknown in the signal design. Simulations demonstrate the performance, and show that our noise design outperforms other methods.

Vision-Language Pretraining (VLP) and Foundation models have been the go-to recipe for achieving SoTA performance on general benchmarks. However, leveraging these powerful techniques for more complex vision-language tasks, such as cooking applications, with more structured input data, is still little investigated. In this work, we propose to leverage these techniques for structured-text based computational cuisine tasks. Our strategy, dubbed VLPCook (Structured Vision-Language Pretraining for Computational Cooking), first transforms existing image-text pairs to image and structured-text pairs. This allows to pretrain our VLPCook model using VLP objectives adapted to the strutured data of the resulting datasets, then finetuning it on downstream computational cooking tasks. During finetuning, we also enrich the visual encoder, leveraging pretrained foundation models (e.g. CLIP) to provide local and global textual context. VLPCook outperforms current SoTA by a significant margin (+3.3 Recall@1 absolute improvement) on the task of Cross-Modal Food Retrieval on the large Recipe1M dataset. Finally, we conduct further experiments on VLP to validate their importance, especially on the Recipe1M+ dataset. The code will be made publicly available.  ( 2 min )

Behavioural cloning (BC) is a commonly used imitation learning method to infer a sequential decision-making policy from expert demonstrations. However, when the quality of the data is not optimal, the resulting behavioural policy also performs sub-optimally once deployed. Recently, there has been a surge in offline reinforcement learning methods that hold the promise to extract high-quality policies from sub-optimal historical data. A common approach is to perform regularisation during training, encouraging updates during policy evaluation and/or policy improvement to stay close to the underlying data. In this work, we investigate whether an offline approach to improving the quality of the existing data can lead to improved behavioural policies without any changes in the BC algorithm. The proposed data improvement approach - Trajectory Stitching (TS) - generates new trajectories (sequences of states and actions) by `stitching' pairs of states that were disconnected in the original data and generating their connecting new action. By construction, these new transitions are guaranteed to be highly plausible according to probabilistic models of the environment, and to improve a state-value function. We demonstrate that the iterative process of replacing old trajectories with new ones incrementally improves the underlying behavioural policy. Extensive experimental results show that significant performance gains can be achieved using TS over BC policies extracted from the original data. Furthermore, using the D4RL benchmarking suite, we demonstrate that state-of-the-art results are obtained by combining TS with two existing offline learning methodologies reliant on BC, model-based offline planning (MBOP) and policy constraint (TD3+BC).

In the cybersecurity setting, defenders are often at the mercy of their detection technologies and subject to the information and experiences that individual analysts have. In order to give defenders an advantage, it is important to understand an attacker's motivation and their likely next best action. As a first step in modeling this behavior, we introduce a security game framework that simulates interplay between attackers and defenders in a noisy environment, focusing on the factors that drive decision making for attackers and defenders in the variants of the game with full knowledge and observability, knowledge of the parameters but no observability of the state (``partial knowledge''), and zero knowledge or observability (``zero knowledge''). We demonstrate the importance of making the right assumptions about attackers, given significant differences in outcomes. Furthermore, there is a measurable trade-off between false-positives and true-positives in terms of attacker outcomes, suggesting that a more false-positive prone environment may be acceptable under conditions where true-positives are also higher.  ( 2 min )

GTFLAT, as a game theory-based add-on, addresses an important research question: How can a federated learning algorithm achieve better performance and training efficiency by setting more effective adaptive weights for averaging in the model aggregation phase? The main objectives for the ideal method of answering the question are: (1) empowering federated learning algorithms to reach better performance in fewer communication rounds, notably in the face of heterogeneous scenarios, and last but not least, (2) being easy to use alongside the state-of-the-art federated learning algorithms as a new module. To this end, GTFLAT models the averaging task as a strategic game among active users. Then it proposes a systematic solution based on the population game and evolutionary dynamics to find the equilibrium. In contrast with existing approaches that impose the weights on the participants, GTFLAT concludes a self-enforcement agreement among clients in a way that none of them is motivated to deviate from it individually. The results reveal that, on average, using GTFLAT increases the top-1 test accuracy by 1.38%, while it needs 21.06% fewer communication rounds to reach the accuracy.  ( 2 min )

Bias elimination and recent probing studies attempt to remove specific information from embedding spaces. Here it is important to remove as much of the target information as possible, while preserving any other information present. INLP is a popular recent method which removes specific information through iterative nullspace projections. Multiple iterations, however, increase the risk that information other than the target is negatively affected. We introduce two methods that find a single targeted projection: Mean Projection (MP, more efficient) and Tukey Median Projection (TMP, with theoretical guarantees). Our comparison between MP and INLP shows that (1) one MP projection removes linear separability based on the target and (2) MP has less impact on the overall space. Further analysis shows that applying random projections after MP leads to the same overall effects on the embedding space as the multiple projections of INLP. Applying one targeted (MP) projection hence is methodologically cleaner than applying multiple (INLP) projections that introduce random effects.  ( 2 min )

Neural networks, especially the recent proposed neural operator models, are increasingly being used to find the solution operator of differential equations. Compared to traditional numerical solvers, they are much faster and more efficient in practical applications. However, one critical issue is that training neural operator models require large amount of ground truth data, which usually comes from the slow numerical solvers. In this paper, we propose a physics-guided data augmentation (PGDA) method to improve the accuracy and generalization of neural operator models. Training data is augmented naturally through the physical properties of differential equations such as linearity and translation. We demonstrate the advantage of PGDA on a variety of linear differential equations, showing that PGDA can improve the sample complexity and is robust to distributional shift.  ( 2 min )

Well-annotated medical datasets enable deep neural networks (DNNs) to gain strong power in extracting lesion-related features. Building such large and well-designed medical datasets is costly due to the need for high-level expertise. Model pre-training based on ImageNet is a common practice to gain better generalization when the data amount is limited. However, it suffers from the domain gap between natural and medical images. In this work, we pre-train DNNs on ultrasound (US) domains instead of ImageNet to reduce the domain gap in medical US applications. To learn US image representations based on unlabeled US videos, we propose a novel meta-learning-based contrastive learning method, namely Meta Ultrasound Contrastive Learning (Meta-USCL). To tackle the key challenge of obtaining semantically consistent sample pairs for contrastive learning, we present a positive pair generation module along with an automatic sample weighting module based on meta-learning. Experimental results on multiple computer-aided diagnosis (CAD) problems, including pneumonia detection, breast cancer classification, and breast tumor segmentation, show that the proposed self-supervised method reaches state-of-the-art (SOTA). The codes are available at https://github.com/Schuture/Meta-USCL.  ( 2 min )

Large deep learning models have achieved remarkable success in many scenarios. However, training large models is usually challenging, e.g., due to the high computational cost, the unstable and painfully slow optimization procedure, and the vulnerability to overfitting. To alleviate these problems, this work studies a divide-and-conquer strategy, i.e., dividing a large model into smaller modules, training them independently, and reassembling the trained modules to obtain the target model. This approach is promising since it avoids directly training large models from scratch. Nevertheless, implementing this idea is non-trivial, as it is difficult to ensure the compatibility of the independently trained modules. In this paper, we present an elegant solution to address this issue, i.e., we introduce a global, shared meta model to implicitly link all the modules together. This enables us to train highly compatible modules that collaborate effectively when they are assembled together. We further propose a module incubation mechanism that enables the meta model to be designed as an extremely shallow network. As a result, the additional overhead introduced by the meta model is minimalized. Though conceptually simple, our method significantly outperforms end-to-end (E2E) training in terms of both final accuracy and training efficiency. For example, on top of ViT-Huge, it improves the accuracy by 2.7% compared to the E2E baseline on ImageNet-1K, while saving the training cost by 43% in the meantime. Code is available at https://github.com/LeapLabTHU/Model-Assembling.  ( 2 min )

Federated learning has been predominantly concerned with collaborative training of deep networks from scratch, and especially the many challenges that arise, such as communication cost, robustness to heterogeneous data, and support for diverse device capabilities. However, there is no unified framework that addresses all these problems together. This paper studies the challenges and opportunities of exploiting pre-trained Transformer models in FL. In particular, we propose to efficiently adapt such pre-trained models by injecting a novel attention-based adapter module at each transformer block that both modulates the forward pass and makes an early prediction. Training only the lightweight adapter by FL leads to fast and communication-efficient learning even in the presence of heterogeneous data and devices. Extensive experiments on standard FL benchmarks, including CIFAR-100, FEMNIST and SpeechCommandsv2 demonstrate that this simple framework provides fast and accurate FL while supporting heterogenous device capabilities, efficient personalization, and scalable-cost anytime inference.  ( 2 min )

We propose an interactive editing method that allows humans to help deep neural networks (DNNs) learn a latent space more consistent with human knowledge, thereby improving classification accuracy on indistinguishable ambiguous data. Firstly, we visualize high-dimensional data features through dimensionality reduction methods and design an interactive system \textit{SpaceEditing} to display the visualized data. \textit{SpaceEditing} provides a 2D workspace based on the idea of spatial layout. In this workspace, the user can move the projection data in it according to the system guidance. Then, \textit{SpaceEditing} will find the corresponding high-dimensional features according to the projection data moved by the user, and feed the high-dimensional features back to the network for retraining, therefore achieving the purpose of interactively modifying the high-dimensional latent space for the user. Secondly, to more rationally incorporate human knowledge into the training process of neural networks, we design a new loss function that enables the network to learn user-modified information. Finally, We demonstrate how \textit{SpaceEditing} meets user needs through three case studies while evaluating our proposed new method, and the results confirm the effectiveness of our method.  ( 2 min )

A significant body of research in the data sciences considers unfair discrimination against social categories such as race or gender that could occur or be amplified as a result of algorithmic decisions. Simultaneously, real-world disparities continue to exist, even before algorithmic decisions are made. In this work, we draw on insights from the social sciences brought into the realm of causal modeling and constrained optimization, and develop a novel algorithmic framework for tackling pre-existing real-world disparities. The purpose of our framework, which we call the "impact remediation framework," is to measure real-world disparities and discover the optimal intervention policies that could help improve equity or access to opportunity for those who are underserved with respect to an outcome of interest. We develop a disaggregated approach to tackling pre-existing disparities that relaxes the typical set of assumptions required for the use of social categories in structural causal models. Our approach flexibly incorporates counterfactuals and is compatible with various ontological assumptions about the nature of social categories. We demonstrate impact remediation with a hypothetical case study and compare our disaggregated approach to an existing state-of-the-art approach, comparing its structure and resulting policy recommendations. In contrast to most work on optimal policy learning, we explore disparity reduction itself as an objective, explicitly focusing the power of algorithms on reducing inequality.  ( 2 min )

The group synchronization problem involves estimating a collection of group elements from noisy measurements of their pairwise ratios. This task is a key component in many computational problems, including the molecular reconstruction problem in single-particle cryo-electron microscopy (cryo-EM). The standard methods to estimate the group elements are based on iteratively applying linear and non-linear operators, and are not necessarily optimal. Motivated by the structural similarity to deep neural networks, we adopt the concept of algorithm unrolling, where training data is used to optimize the algorithm. We design unrolled algorithms for several group synchronization instances, including synchronization over the group of 3-D rotations: the synchronization problem in cryo-EM. We also apply a similar approach to the multi-reference alignment problem. We show by numerical experiments that the unrolling strategy outperforms existing synchronization algorithms in a wide variety of scenarios.  ( 2 min )

Recent development in the field of explainable artificial intelligence (XAI) has helped improve trust in Machine-Learning-as-a-Service (MLaaS) systems, in which an explanation is provided together with the model prediction in response to each query. However, XAI also opens a door for adversaries to gain insights into the black-box models in MLaaS, thereby making the models more vulnerable to several attacks. For example, feature-based explanations (e.g., SHAP) could expose the top important features that a black-box model focuses on. Such disclosure has been exploited to craft effective backdoor triggers against malware classifiers. To address this trade-off, we introduce a new concept of achieving local differential privacy (LDP) in the explanations, and from that we establish a defense, called XRand, against such attacks. We show that our mechanism restricts the information that the adversary can learn about the top important features, while maintaining the faithfulness of the explanations.  ( 2 min )

Modern machine learning requires system designers to specify aspects of the learning pipeline, such as losses, architectures, and optimizers. Meta-learning, or learning-to-learn, instead aims to learn those aspects, and promises to unlock greater capabilities with less manual effort. One particularly ambitious goal of meta-learning is to train general-purpose in-context learning algorithms from scratch, using only black-box models with minimal inductive bias. Such a model takes in training data, and produces test-set predictions across a wide range of problems, without any explicit definition of an inference model, training loss, or optimization algorithm. In this paper we show that Transformers and other black-box models can be meta-trained to act as general-purpose in-context learners. We characterize phase transitions between algorithms that generalize, algorithms that memorize, and algorithms that fail to meta-train at all, induced by changes in model size, number of tasks, and meta-optimization. We further show that the capabilities of meta-trained algorithms are bottlenecked by the accessible state size (memory) determining the next prediction, unlike standard models which are thought to be bottlenecked by parameter count. Finally, we propose practical interventions such as biasing the training distribution that improve the meta-training and meta-generalization of general-purpose learning algorithms.  ( 2 min )

The linearised Laplace method for estimating model uncertainty has received renewed attention in the Bayesian deep learning community. The method provides reliable error bars and admits a closed-form expression for the model evidence, allowing for scalable selection of model hyperparameters. In this work, we examine the assumptions behind this method, particularly in conjunction with model selection. We show that these interact poorly with some now-standard tools of deep learning--stochastic approximation methods and normalisation layers--and make recommendations for how to better adapt this classic method to the modern setting. We provide theoretical support for our recommendations and validate them empirically on MLPs, classic CNNs, residual networks with and without normalisation layers, generative autoencoders and transformers.  ( 2 min )

Changing how pre-trained models behave -- e.g., improving their performance on a downstream task or mitigating biases learned during pre-training -- is a common practice when developing machine learning systems. In this work, we propose a new paradigm for steering the behavior of neural networks, centered around \textit{task vectors}. A task vector specifies a direction in the weight space of a pre-trained model, such that movement in that direction improves performance on the task. We build task vectors by subtracting the weights of a pre-trained model from the weights of the same model after fine-tuning on a task. We show that these task vectors can be modified and combined together through arithmetic operations such as negation and addition, and the behavior of the resulting model is steered accordingly. Negating a task vector decreases performance on the target task, with little change in model behavior on control tasks. Moreover, adding task vectors together can improve performance on multiple tasks at once. Finally, when tasks are linked by an analogy relationship of the form ``A is to B as C is to D", combining task vectors from three of the tasks can improve performance on the fourth, even when no data from the fourth task is used for training. Overall, our experiments with several models, modalities and tasks show that task arithmetic is a simple, efficient and effective way of editing models.  ( 2 min )

We study distributed contextual linear bandits with stochastic contexts, where $N$ agents act cooperatively to solve a linear bandit-optimization problem with $d$-dimensional features over the course of $T$ rounds. For this problem, we derive the first ever information-theoretic lower bound $\Omega(dN)$ on the communication cost of any algorithm that performs optimally in a regret minimization setup. We then propose a distributed batch elimination version of the LinUCB algorithm, DisBE-LUCB, where the agents share information among each other through a central server. We prove that the communication cost of DisBE-LUCB matches our lower bound up to logarithmic factors. In particular, for scenarios with known context distribution, the communication cost of DisBE-LUCB is only $\tilde{\mathcal{O}}(dN)$ and its regret is ${\tilde{\mathcal{O}}}(\sqrt{dNT})$, which is of the same order as that incurred by an optimal single-agent algorithm for $NT$ rounds. We also provide similar bounds for practical settings where the context distribution can only be estimated. Therefore, our proposed algorithm is nearly minimax optimal in terms of \emph{both regret and communication cost}. Finally, we propose DecBE-LUCB, a fully decentralized version of DisBE-LUCB, which operates without a central server, where agents share information with their \emph{immediate neighbors} through a carefully designed consensus procedure.  ( 2 min )

Machine Learning (ML) is changing DBs as many DB components are being replaced by ML models. One open problem in this setting is how to update such ML models in the presence of data updates. We start this investigation focusing on data insertions (dominating updates in analytical DBs). We study how to update neural network (NN) models when new data follows a different distribution (a.k.a. it is "out-of-distribution" -- OOD), rendering previously-trained NNs inaccurate. A requirement in our problem setting is that learned DB components should ensure high accuracy for tasks on old and new data (e.g., for approximate query processing (AQP), cardinality estimation (CE), synthetic data generation (DG), etc.). This paper proposes a novel updatability framework (DDUp). DDUp can provide updatability for different learned DB system components, even based on different NNs, without the high costs to retrain the NNs from scratch. DDUp entails two components: First, a novel, efficient, and principled statistical-testing approach to detect OOD data. Second, a novel model updating approach, grounded on the principles of transfer learning with knowledge distillation, to update learned models efficiently, while still ensuring high accuracy. We develop and showcase DDUp's applicability for three different learned DB components, AQP, CE, and DG, each employing a different type of NN. Detailed experimental evaluation using real and benchmark datasets for AQP, CE, and DG detail DDUp's performance advantages.  ( 2 min )

In recent years, using a self-supervised learning framework to learn the general characteristics of graphs has been considered a promising paradigm for graph representation learning. The core of self-supervised learning strategies for graph neural networks lies in constructing suitable positive sample selection strategies. However, existing GNNs typically aggregate information from neighboring nodes to update node representations, leading to an over-reliance on neighboring positive samples, i.e., homophilous samples; while ignoring long-range positive samples, i.e., positive samples that are far apart on the graph but structurally equivalent samples, a problem we call "neighbor bias." This neighbor bias can reduce the generalization performance of GNNs. In this paper, we argue that the generalization properties of GNNs should be determined by combining homogeneous samples and structurally equivalent samples, which we call the "GC combination hypothesis." Therefore, we propose a topological signal-driven self-supervised method. It uses a topological information-guided structural equivalence sampling strategy. First, we extract multiscale topological features using persistent homology. Then we compute the structural equivalence of node pairs based on their topological features. In particular, we design a topological loss function to pull in non-neighboring node pairs with high structural equivalence in the representation space to alleviate neighbor bias. Finally, we use the joint training mechanism to adjust the effect of structural equivalence on the model to fit datasets with different characteristics. We conducted experiments on the node classification task across seven graph datasets. The results show that the model performance can be effectively improved using a strategy of topological signal enhancement.  ( 2 min )

As spatial audio is enjoying a surge in popularity, data-driven machine learning techniques that have been proven successful in other domains are increasingly used to process head-related transfer function measurements. However, these techniques require much data, whereas the existing datasets are ranging from tens to the low hundreds of datapoints. It therefore becomes attractive to combine multiple of these datasets, although they are measured under different conditions. In this paper, we first establish the common ground between a number of datasets, then we investigate potential pitfalls of mixing datasets. We perform a simple experiment to test the relevance of the remaining differences between datasets when applying machine learning techniques. Finally, we pinpoint the most relevant differences.  ( 2 min )

We propose the framework of dual convexified convolutional neural networks (DCCNNs). In this framework, we first introduce a primal learning problem motivated by convexified convolutional neural networks (CCNNs), and then construct the dual convex training program through careful analysis of the Karush-Kuhn-Tucker (KKT) conditions and Fenchel conjugates. Our approach reduces the computational overhead of constructing a large kernel matrix and more importantly, eliminates the ambiguity of factorizing the matrix. Due to the low-rank structure in CCNNs and the related subdifferential of nuclear norms, there is no closed-form expression to recover the primal solution from the dual solution. To overcome this, we propose a highly novel weight recovery algorithm, which takes the dual solution and the kernel information as the input, and recovers the linear weight and the output of convolutional layer, instead of weight parameter. Furthermore, our recovery algorithm exploits the low-rank structure and imposes a small number of filters indirectly, which reduces the parameter size. As a result, DCCNNs inherit all the statistical benefits of CCNNs, while enjoying a more formal and efficient workflow.  ( 2 min )

Many dynamical systems exhibit latent states with intrinsic orderings such as "ally", "neutral" and "enemy" relationships in international relations. Such latent states are evidenced through entities' cooperative versus conflictual interactions which are similarly ordered. Models of such systems often involve state-to-action emission and state-to-state transition matrices. It is common practice to assume that the rows of these stochastic matrices are independently sampled from a Dirichlet distribution. However, this assumption discards ordinal information and treats states and actions falsely as order-invariant categoricals, which hinders interpretation and evaluation. To address this problem, we propose the Ordered Matrix Dirichlet (OMD): rows are sampled conditionally dependent such that probability mass is shifted to the right of the matrix as we move down rows. This results in a well-ordered mapping between latent states and observed action types. We evaluate the OMD in two settings: a Hidden Markov Model and a novel Bayesian Dynamic Poisson Tucker Model tailored to political event data. Models built on the OMD recover interpretable latent states and show superior forecasting performance in few-shot settings. We detail the wide applicability of the OMD to other domains where models with Dirichlet-sampled matrices are popular (e.g. topic modeling) and publish user-friendly code.  ( 2 min )

Transformer-based models show their effectiveness across multiple domains and tasks. The self-attention allows to combine information from all sequence elements into context-aware representations. However, global and local information has to be stored mostly in the same element-wise representations. Moreover, the length of an input sequence is limited by quadratic computational complexity of self-attention. In this work, we propose and study a memory-augmented segment-level recurrent Transformer (RMT). Memory allows to store and process local and global information as well as to pass information between segments of the long sequence with the help of recurrence. We implement a memory mechanism with no changes to Transformer model by adding special memory tokens to the input or output sequence. Then the model is trained to control both memory operations and sequence representations processing. Results of experiments show that RMT performs on par with the Transformer-XL on language modeling for smaller memory sizes and outperforms it for tasks that require longer sequence processing. We show that adding memory tokens to Tr-XL is able to improve its performance. This makes Recurrent Memory Transformer a promising architecture for applications that require learning of long-term dependencies and general purpose in memory processing, such as algorithmic tasks and reasoning.  ( 2 min )

Object detection requires substantial labeling effort for learning robust models. Active learning can reduce this effort by intelligently selecting relevant examples to be annotated. However, selecting these examples properly without introducing a sampling bias with a negative impact on the generalization performance is not straightforward and most active learning techniques can not hold their promises on real-world benchmarks. In our evaluation paper, we focus on active learning techniques without a computational overhead besides inference, something we refer to as zero-cost active learning. In particular, we show that a key ingredient is not only the score on a bounding box level but also the technique used for aggregating the scores for ranking images. We outline our experimental setup and also discuss practical considerations when using active learning for object detection.  ( 2 min )

Learning about physical systems from quantum-enhanced experiments, relying on a quantum memory and quantum processing, can outperform learning from experiments in which only classical memory and processing are available. Whereas quantum advantages have been established for a variety of state learning tasks, quantum process learning allows for comparable advantages only with a careful problem formulation and is less understood. We establish an exponential quantum advantage for learning an unknown $n$-qubit quantum process $\mathcal{N}$. We show that a quantum memory allows to efficiently solve the following tasks: (a) learning the Pauli transfer matrix of an arbitrary $\mathcal{N}$, (b) predicting expectation values of bounded Pauli-sparse observables measured on the output of an arbitrary $\mathcal{N}$ upon input of a Pauli-sparse state, and (c) predicting expectation values of arbitrary bounded observables measured on the output of an unknown $\mathcal{N}$ with sparse Pauli transfer matrix upon input of an arbitrary state. With quantum memory, these tasks can be solved using linearly-in-$n$ many copies of the Choi state of $\mathcal{N}$, and even time-efficiently in the case of (b). In contrast, any learner without quantum memory requires exponentially-in-$n$ many queries, even when querying $\mathcal{N}$ on subsystems of adaptively chosen states and performing adaptively chosen measurements. In proving this separation, we extend existing shadow tomography upper and lower bounds from states to channels via the Choi-Jamiolkowski isomorphism. Moreover, we combine Pauli transfer matrix learning with polynomial interpolation techniques to develop a procedure for learning arbitrary Hamiltonians, which may have non-local all-to-all interactions, from short-time dynamics. Our results highlight the power of quantum-enhanced experiments for learning highly complex quantum dynamics.  ( 2 min )

Many machine learning problems encode their data as a matrix with a possibly very large number of rows and columns. In several applications like neuroscience, image compression or deep reinforcement learning, the principal subspace of such a matrix provides a useful, low-dimensional representation of individual data. Here, we are interested in determining the $d$-dimensional principal subspace of a given matrix from sample entries, i.e. from small random submatrices. Although a number of sample-based methods exist for this problem (e.g. Oja's rule \citep{oja1982simplified}), these assume access to full columns of the matrix or particular matrix structure such as symmetry and cannot be combined as-is with neural networks \citep{baldi1989neural}. In this paper, we derive an algorithm that learns a principal subspace from sample entries, can be applied when the approximate subspace is represented by a neural network, and hence can be scaled to datasets with an effectively infinite number of rows and columns. Our method consists in defining a loss function whose minimizer is the desired principal subspace, and constructing a gradient estimate of this loss whose bias can be controlled. We complement our theoretical analysis with a series of experiments on synthetic matrices, the MNIST dataset \citep{lecun2010mnist} and the reinforcement learning domain PuddleWorld \citep{sutton1995generalization} demonstrating the usefulness of our approach.  ( 2 min )

Generative models, particularly GANs, have been utilized for image editing. Although GAN-based methods perform well on generating reasonable contents aligned with the user's intentions, they struggle to strictly preserve the contents outside the editing region. To address this issue, we use diffusion models instead of GANs and propose a novel image-editing method, based on pixel-wise guidance. Specifically, we first train pixel-classifiers with few annotated data and then estimate the semantic segmentation map of a target image. Users then manipulate the map to instruct how the image is to be edited. The diffusion model generates an edited image via guidance by pixel-wise classifiers, such that the resultant image aligns with the manipulated map. As the guidance is conducted pixel-wise, the proposed method can create reasonable contents in the editing region while preserving the contents outside this region. The experimental results validate the advantages of the proposed method both quantitatively and qualitatively.  ( 2 min )

Identifying similar network structures is key to capture graph isomorphisms and learn representations that exploit structural information encoded in graph data. This work shows that ego-networks can produce a structural encoding scheme for arbitrary graphs with greater expressivity than the Weisfeiler-Lehman (1-WL) test. We introduce IGEL, a preprocessing step to produce features that augment node representations by encoding ego-networks into sparse vectors that enrich Message Passing (MP) Graph Neural Networks (GNNs) beyond 1-WL expressivity. We describe formally the relation between IGEL and 1-WL, and characterize its expressive power and limitations. Experiments show that IGEL matches the empirical expressivity of state-of-the-art methods on isomorphism detection while improving performance on seven GNN architectures.  ( 2 min )

This study focuses on embodied agents that can follow natural language instructions to complete complex tasks in a visually-perceived environment. Existing methods rely on a large amount of (instruction, gold trajectory) pairs to learn a good policy. The high data cost and poor sample efficiency prevents the development of versatile agents that are capable of many tasks and can learn new tasks quickly. In this work, we propose a novel method, LLM-Planner, that harnesses the power of large language models (LLMs) such as GPT-3 to do few-shot planning for embodied agents. We further propose a simple but effective way to enhance LLMs with physical grounding to generate plans that are grounded in the current environment. Experiments on the ALFRED dataset show that our method can achieve very competitive few-shot performance, even outperforming several recent baselines that are trained using the full training data despite using less than 0.5% of paired training data. Existing methods can barely complete any task successfully under the same few-shot setting. Our work opens the door for developing versatile and sample-efficient embodied agents that can quickly learn many tasks.  ( 2 min )

The task of emotion recognition in conversations (ERC) benefits from the availability of multiple modalities, as offered, for example, in the video-based MELD dataset. However, only a few research approaches use both acoustic and visual information from the MELD videos. There are two reasons for this: First, label-to-video alignments in MELD are noisy, making those videos an unreliable source of emotional speech data. Second, conversations can involve several people in the same scene, which requires the detection of the person speaking the utterance. In this paper we demonstrate that by using recent automatic speech recognition and active speaker detection models, we are able to realign the videos of MELD, and capture the facial expressions from uttering speakers in 96.92% of the utterances provided in MELD. Experiments with a self-supervised voice recognition model indicate that the realigned MELD videos more closely match the corresponding utterances offered in the dataset. Finally, we devise a model for emotion recognition in conversations trained on the face and audio information of the MELD realigned videos, which outperforms state-of-the-art models for ERC based on vision alone. This indicates that active speaker detection is indeed effective for extracting facial expressions from the uttering speakers, and that faces provide more informative visual cues than the visual features state-of-the-art models have been using so far.  ( 2 min )

Multi-hop Machine reading comprehension is a challenging task with aim of answering a question based on disjoint pieces of information across the different passages. The evaluation metrics and datasets are a vital part of multi-hop MRC because it is not possible to train and evaluate models without them, also, the proposed challenges by datasets often are an important motivation for improving the existing models. Due to increasing attention to this field, it is necessary and worth reviewing them in detail. This study aims to present a comprehensive survey on recent advances in multi-hop MRC evaluation metrics and datasets. In this regard, first, the multi-hop MRC problem definition will be presented, then the evaluation metrics based on their multi-hop aspect will be investigated. Also, 15 multi-hop datasets have been reviewed in detail from 2017 to 2022, and a comprehensive analysis has been prepared at the end. Finally, open issues in this field have been discussed.  ( 2 min )

Traditional power grid systems have become obsolete under more frequent and extreme natural disasters. Reinforcement learning (RL) has been a promising solution for resilience given its successful history of power grid control. However, most power grid simulators and RL interfaces do not support simulation of power grid under large-scale blackouts or when the network is divided into sub-networks. In this study, we proposed an updated power grid simulator built on Grid2Op, an existing simulator and RL interface, and experimented on limiting the action and observation spaces of Grid2Op. By testing with DDQN and SliceRDQN algorithms, we found that reduced action spaces significantly improve training performance and efficiency. In addition, we investigated a low-rank neural network regularization method for deep Q-learning, one of the most widely used RL algorithms, in this power grid control scenario. As a result, the experiment demonstrated that in the power grid simulation environment, adopting this method will significantly increase the performance of RL agents.  ( 2 min )

Physics-Informed Neural Networks (PINNs) have recently been proposed to solve scientific and engineering problems, where physical laws are introduced into neural networks as prior knowledge. With the embedded physical laws, PINNs enable the estimation of critical parameters, which are unobservable via physical tools, through observable variables. For example, Power Electronic Converters (PECs) are essential building blocks for the green energy transition. PINNs have been applied to estimate the capacitance, which is unobservable during PEC operations, using current and voltage, which can be observed easily during operations. The estimated capacitance facilitates self-diagnostics of PECs. Existing PINNs are often manually designed, which is time-consuming and may lead to suboptimal performance due to a large number of design choices for neural network architectures and hyperparameters. In addition, PINNs are often deployed on different physical devices, e.g., PECs, with limited and varying resources. Therefore, it requires designing different PINN models under different resource constraints, making it an even more challenging task for manual design. To contend with the challenges, we propose Automated Physics-Informed Neural Networks (AutoPINN), a framework that enables the automated design of PINNs by combining AutoML and PINNs. Specifically, we first tailor a search space that allows finding high-accuracy PINNs for PEC internal parameter estimation. We then propose a resource-aware search strategy to explore the search space to find the best PINN model under different resource constraints. We experimentally demonstrate that AutoPINN is able to find more accurate PINN models than human-designed, state-of-the-art PINN models using fewer resources.  ( 2 min )

As more and more artificial intelligence (AI) technologies move from the laboratory to real-world applications, the open-set and robustness challenges brought by data from the real world have received increasing attention. Data augmentation is a widely used method to improve model performance, and some recent works have also confirmed its positive effect on the robustness of AI models. However, most of the existing data augmentation methods are heuristic, lacking the exploration of their internal mechanisms. We apply the explainable artificial intelligence (XAI) method, explore the internal mechanisms of popular data augmentation methods, analyze the relationship between game interactions and some widely used robustness metrics, and propose a new proxy for model robustness in the open-set environment. Based on the analysis of the internal mechanisms, we develop a mask-based boosting method for data augmentation that comprehensively improves several robustness measures of AI models and beats state-of-the-art data augmentation approaches. Experiments show that our method can be widely applied to many popular data augmentation methods. Different from the adversarial training, our boosting method not only significantly improves the robustness of models, but also improves the accuracy of test sets. Our code is available at \url{https://github.com/Anonymous_for_submission}.  ( 2 min )

Recently, automated co-design of machine learning (ML) models and accelerator architectures has attracted significant attention from both the industry and academia. However, most co-design frameworks either explore a limited search space or employ suboptimal exploration techniques for simultaneous design decision investigations of the ML model and the accelerator. Furthermore, training the ML model and simulating the accelerator performance is computationally expensive. To address these limitations, this work proposes a novel neural architecture and hardware accelerator co-design framework, called CODEBench. It is composed of two new benchmarking sub-frameworks, CNNBench and AccelBench, which explore expanded design spaces of convolutional neural networks (CNNs) and CNN accelerators. CNNBench leverages an advanced search technique, BOSHNAS, to efficiently train a neural heteroscedastic surrogate model to converge to an optimal CNN architecture by employing second-order gradients. AccelBench performs cycle-accurate simulations for a diverse set of accelerator architectures in a vast design space. With the proposed co-design method, called BOSHCODE, our best CNN-accelerator pair achieves 1.4% higher accuracy on the CIFAR-10 dataset compared to the state-of-the-art pair, while enabling 59.1% lower latency and 60.8% lower energy consumption. On the ImageNet dataset, it achieves 3.7% higher Top1 accuracy at 43.8% lower latency and 11.2% lower energy consumption. CODEBench outperforms the state-of-the-art framework, i.e., Auto-NBA, by achieving 1.5% higher accuracy and 34.7x higher throughput, while enabling 11.0x lower energy-delay product (EDP) and 4.0x lower chip area on CIFAR-10.  ( 2 min )

Gathering properly labelled, adequately rich, and case-specific data for successfully training a data-driven or hybrid model for structural health monitoring (SHM) applications is a challenging task. We posit that a Transfer Learning (TL) method that utilizes available data in any relevant source domain and directly applies to the target domain through domain adaptation can provide substantial remedies to address this issue. Accordingly, we present a novel TL method that differentiates between the source's no-damage and damage cases and utilizes a domain adaptation (DA) technique. The DA module transfers the accumulated knowledge in contrasting no-damage and damage cases in the source domain to the target domain, given only the target's no-damage case. High-dimensional features allow employing signal processing domain knowledge to devise a generalizable DA approach. The Generative Adversarial Network (GAN) architecture is adopted for learning since its optimization process accommodates high-dimensional inputs in a zero-shot setting. At the same time, its training objective conforms seamlessly with the case of no-damage and damage data in SHM since its discriminator network differentiates between real (no damage) and fake (possibly unseen damage) data. An extensive set of experimental results demonstrates the method's success in transferring knowledge on differences between no-damage and damage cases across three strongly heterogeneous independent target structures. The area under the Receiver Operating Characteristics curves (Area Under the Curve - AUC) is used to evaluate the differentiation between no-damage and damage cases in the target domain, reaching values as high as 0.95. With no-damage and damage cases discerned from each other, zero-shot structural damage detection is carried out. The mean F1 scores for all damages in the three independent datasets are 0.978, 0.992, and 0.975.  ( 2 min )

Influence diagnostics such as influence functions and approximate maximum influence perturbations are popular in machine learning and in AI domain applications. Influence diagnostics are powerful statistical tools to identify influential datapoints or subsets of datapoints. We establish finite-sample statistical bounds, as well as computational complexity bounds, for influence functions and approximate maximum influence perturbations using efficient inverse-Hessian-vector product implementations. We illustrate our results with generalized linear models and large attention based models on synthetic and real data.  ( 2 min )

Artificial Intelligence (AI) systems have been increasingly used to make decision-making processes faster, more accurate, and more efficient. However, such systems are also at constant risk of being attacked. While the majority of attacks targeting AI-based applications aim to manipulate classifiers or training data and alter the output of an AI model, recently proposed Sponge Attacks against AI models aim to impede the classifier's execution by consuming substantial resources. In this work, we propose \textit{Dual Denial of Decision (DDoD) attacks against collaborative Human-AI teams}. We discuss how such attacks aim to deplete \textit{both computational and human} resources, and significantly impair decision-making capabilities. We describe DDoD on human and computational resources and present potential risk scenarios in a series of exemplary domains.  ( 2 min )

As many deep anomaly detection models have been deployed in the real-world, interpretable anomaly detection becomes an emerging task. Recent studies focus on identifying features of samples leading to abnormal outcomes but cannot recommend a set of actions to flip the abnormal outcomes. In this work, we focus on interpretations via algorithmic recourse that shows how to act to revert abnormal predictions by suggesting actions on features. The key challenge is that algorithmic recourse involves interventions in the physical world, which is fundamentally a causal problem. To tackle this challenge, we propose an interpretable Anomaly Detection framework using Causal Algorithmic Recourse (ADCAR), which recommends recourse actions and infers counterfactual of abnormal samples guided by the causal mechanism. Experiments on three datasets show that ADCAR can flip the abnormal labels with minimal interventions.  ( 2 min )

Multi-label ranking maps instances to a ranked set of predicted labels from multiple possible classes. The ranking approach for multi-label learning problems received attention for its success in multi-label classification, with one of the well-known approaches being pairwise label ranking. However, most existing methods assume that only partial information about the preference relation is known, which is inferred from the partition of labels into a positive and negative set, then treat labels with equal importance. In this paper, we focus on the unique challenge of ranking when the order of the true label set is provided. We propose a novel dedicated loss function to optimize models by incorporating penalties for incorrectly ranked pairs, and make use of the ranking information present in the input. Our method achieves the best reported performance measures on both synthetic and real world ranked datasets and shows improvements on overall ranking of labels. Our experimental results demonstrate that our approach is generalizable to a variety of multi-label classification and ranking tasks, while revealing a calibration towards a certain ranking ordering.  ( 2 min )

There is considerable interest in predicting the pathogenicity of protein variants in human genes. Due to the sparsity of high quality labels, recent approaches turn to \textit{unsupervised} learning, using Multiple Sequence Alignments (MSAs) to train generative models of natural sequence variation within each gene. These generative models then predict variant likelihood as a proxy to evolutionary fitness. In this work we instead combine this evolutionary principle with pretrained protein language models (LMs), which have already shown promising results in predicting protein structure and function. Instead of training separate models per-gene, we find that a single protein LM trained on broad sequence datasets can score pathogenicity for any gene variant zero-shot, without MSAs or finetuning. We call this unsupervised approach \textbf{VELM} (Variant Effect via Language Models), and show that it achieves scoring performance comparable to the state of the art when evaluated on clinically labeled variants of disease-related genes.  ( 2 min )

Acquiring a better understanding of drought impacts becomes increasingly vital under a warming climate. Traditional drought indices describe mainly biophysical variables and not impacts on social, economic, and environmental systems. We utilized natural language processing and bidirectional encoder representation from Transformers (BERT) based transfer learning to fine-tune the model on the data from the news-based Drought Impact Report (DIR) and then apply it to recognize seven types of drought impacts based on the filtered Twitter data from the United States. Our model achieved a satisfying macro-F1 score of 0.89 on the DIR test set. The model was then applied to California tweets and validated with keyword-based labels. The macro-F1 score was 0.58. However, due to the limitation of keywords, we also spot-checked tweets with controversial labels. 83.5% of BERT labels were correct compared to the keyword labels. Overall, the fine-tuned BERT-based recognizer provided proper predictions and valuable information on drought impacts. The interpretation and analysis of the model were consistent with experiential domain expertise.  ( 2 min )

As the societal impact of Deep Neural Networks (DNNs) grows, the goals for advancing DNNs become more complex and diverse, ranging from improving a conventional model accuracy metric to infusing advanced human virtues such as fairness, accountability, transparency (FaccT), and unbiasedness. Recently, techniques in Explainable Artificial Intelligence (XAI) are attracting considerable attention, and have tremendously helped Machine Learning (ML) engineers in understanding AI models. However, at the same time, we started to witness the emerging need beyond XAI among AI communities; based on the insights learned from XAI, how can we better empower ML engineers in steering their DNNs so that the model's reasonableness and performance can be improved as intended? This article provides a timely and extensive literature overview of the field Explanation-Guided Learning (EGL), a domain of techniques that steer the DNNs' reasoning process by adding regularization, supervision, or intervention on model explanations. In doing so, we first provide a formal definition of EGL and its general learning paradigm. Secondly, an overview of the key factors for EGL evaluation, as well as summarization and categorization of existing evaluation procedures and metrics for EGL are provided. Finally, the current and potential future application areas and directions of EGL are discussed, and an extensive experimental study is presented aiming at providing comprehensive comparative studies among existing EGL models in various popular application domains, such as Computer Vision (CV) and Natural Language Processing (NLP) domains.  ( 2 min )

Searching for a path between two nodes in a graph is one of the most well-studied and fundamental problems in computer science. In numerous domains such as robotics, AI, or biology, practitioners develop search heuristics to accelerate their pathfinding algorithms. However, it is a laborious and complex process to hand-design heuristics based on the problem and the structure of a given use case. Here we present PHIL (Path Heuristic with Imitation Learning), a novel neural architecture and a training algorithm for discovering graph search and navigation heuristics from data by leveraging recent advances in imitation learning and graph representation learning. At training time, we aggregate datasets of search trajectories and ground-truth shortest path distances, which we use to train a specialized graph neural network-based heuristic function using backpropagation through steps of the pathfinding process. Our heuristic function learns graph embeddings useful for inferring node distances, runs in constant time independent of graph sizes, and can be easily incorporated in an algorithm such as A* at test time. Experiments show that PHIL reduces the number of explored nodes compared to state-of-the-art methods on benchmark datasets by 58.5\% on average, can be directly applied in diverse graphs ranging from biological networks to road networks, and allows for fast planning in time-critical robotics domains.  ( 2 min )

Non-convex AC optimal power flow (AC-OPF) is a fundamental optimization problem in power system analysis. The computational complexity of conventional solvers is typically high and not suitable for large-scale networks in real-time operation. Hence, deep learning based approaches have gained intensive attention to conduct the time-consuming training process offline. Supervised learning methods may yield a feasible AC-OPF solution with a small optimality gap. However, they often need conventional solvers to generate the training dataset. This paper proposes an end-to-end unsupervised learning based framework for AC-OPF. We develop a deep neural network to output a partial set of decision variables while the remaining variables are recovered by solving AC power flow equations. The fast decoupled power flow solver is adopted to further reduce the computational time. In addition, we propose using a modified augmented Lagrangian function as the training loss. The multipliers are adjusted dynamically based on the degree of constraint violation. Extensive numerical test results corroborate the advantages of our proposed approach over some existing methods.  ( 2 min )

As ride-hailing services become increasingly popular, being able to accurately predict demand for such services can help operators efficiently allocate drivers to customers, and reduce idle time, improve congestion, and enhance the passenger experience. This paper proposes UberNet, a deep learning Convolutional Neural Network for short-term prediction of demand for ride-hailing services. UberNet empploys a multivariate framework that utilises a number of temporal and spatial features that have been found in the literature to explain demand for ride-hailing services. The proposed model includes two sub-networks that aim to encode the source series of various features and decode the predicting series, respectively. To assess the performance and effectiveness of UberNet, we use 9 months of Uber pickup data in 2014 and 28 spatial and temporal features from New York City. By comparing the performance of UberNet with several other approaches, we show that the prediction quality of the model is highly competitive. Further, Ubernet's prediction performance is better when using economic, social and built environment features. This suggests that Ubernet is more naturally suited to including complex motivators in making real-time passenger demand predictions for ride-hailing services.  ( 2 min )

In off-policy reinforcement learning, a behaviour policy performs exploratory interactions with the environment to obtain state-action-reward samples which are then used to learn a target policy that optimises the expected return. This leads to a problem of off-policy evaluation, where one needs to evaluate the target policy from samples collected by the often unrelated behaviour policy. Importance sampling is a traditional statistical technique that is often applied to off-policy evaluation. While importance sampling estimators are unbiased, their variance increases exponentially with the horizon of the decision process due to computing the importance weight as a product of action probability ratios, yielding estimates with low accuracy for domains involving long-term planning. This paper proposes state-based importance sampling (SIS), which drops the action probability ratios of sub-trajectories with "neglible states" -- roughly speaking, those for which the chosen actions have no impact on the return estimate -- from the computation of the importance weight. Theoretical results show that this results in a reduction of the exponent in the variance upper bound as well as improving the mean squared error. An automated search algorithm based on covariance testing is proposed to identify a negligible state set which has minimal MSE when performing state-based importance sampling. Experiments are conducted on a lift domain, which include "lift states" where the action has no impact on the following state and reward. The results demonstrate that using the search algorithm, SIS yields reduced variance and improved accuracy compared to traditional importance sampling, per-decision importance sampling, and incremental importance sampling.  ( 2 min )

Variational autoencoders (VAEs) are powerful tools for learning latent representations of data used in a wide range of applications. In practice, VAEs usually require multiple training rounds to choose the amount of information the latent variable should retain. This trade-off between the reconstruction error (distortion) and the KL divergence (rate) is typically parameterized by a hyperparameter $\beta$. In this paper, we introduce Multi-Rate VAE (MR-VAE), a computationally efficient framework for learning optimal parameters corresponding to various $\beta$ in a single training run. The key idea is to explicitly formulate a response function that maps $\beta$ to the optimal parameters using hypernetworks. MR-VAEs construct a compact response hypernetwork where the pre-activations are conditionally gated based on $\beta$. We justify the proposed architecture by analyzing linear VAEs and showing that it can represent response functions exactly for linear VAEs. With the learned hypernetwork, MR-VAEs can construct the rate-distortion curve without additional training and can be deployed with significantly less hyperparameter tuning. Empirically, our approach is competitive and often exceeds the performance of multiple $\beta$-VAEs training with minimal computation and memory overheads.  ( 2 min )

Convolutional neural networks (CNNs) have constantly achieved better performance over years by introducing more complex topology, and enlarging the capacity towards deeper and wider CNNs. This makes the manual design of CNNs extremely difficult, so the automated design of CNNs has come into the research spotlight, which has obtained CNNs that outperform manually-designed CNNs. However, the computational cost is still the bottleneck of automatically designing CNNs. In this paper, inspired by transfer learning, a new evolutionary computation based framework is proposed to efficiently evolve CNNs without compromising the classification accuracy. The proposed framework leverages multi-source domains, which are smaller datasets than the target domain datasets, to evolve a generalised CNN block only once. And then, a new stacking method is proposed to both widen and deepen the evolved block, and a grid search method is proposed to find optimal stacking solutions. The experimental results show the proposed method acquires good CNNs faster than 15 peer competitors within less than 40 GPU-hours. Regarding the classification accuracy, the proposed method gains its strong competitiveness against the peer competitors, which achieves the best error rates of 3.46%, 18.36% and 1.76% for the CIFAR-10, CIFAR-100 and SVHN datasets, respectively.  ( 2 min )

Behavioral Cloning (BC) aims at learning a policy that mimics the behavior demonstrated by an expert. The current theoretical understanding of BC is limited to the case of finite actions. In this paper, we study BC with the goal of providing theoretical guarantees on the performance of the imitator policy in the case of continuous actions. We start by deriving a novel bound on the performance gap based on Wasserstein distance, applicable for continuous-action experts, holding under the assumption that the value function is Lipschitz continuous. Since this latter condition is hardy fulfilled in practice, even for Lipschitz Markov Decision Processes and policies, we propose a relaxed setting, proving that value function is always Holder continuous. This result is of independent interest and allows obtaining in BC a general bound for the performance of the imitator policy. Finally, we analyze noise injection, a common practice in which the expert action is executed in the environment after the application of a noise kernel. We show that this practice allows deriving stronger performance guarantees, at the price of a bias due to the noise addition.  ( 2 min )

Over the years, Machine Learning models have been successfully employed on neuroimaging data for accurately predicting brain age. Deviations from the healthy brain aging pattern are associated to the accelerated brain aging and brain abnormalities. Hence, efficient and accurate diagnosis techniques are required for eliciting accurate brain age estimations. Several contributions have been reported in the past for this purpose, resorting to different data-driven modeling methods. Recently, deep neural networks (also referred to as deep learning) have become prevalent in manifold neuroimaging studies, including brain age estimation. In this review, we offer a comprehensive analysis of the literature related to the adoption of deep learning for brain age estimation with neuroimaging data. We detail and analyze different deep learning architectures used for this application, pausing at research works published to date quantitatively exploring their application. We also examine different brain age estimation frameworks, comparatively exposing their advantages and weaknesses. Finally, the review concludes with an outlook towards future directions that should be followed by prospective studies. The ultimate goal of this paper is to establish a common and informed reference for newcomers and experienced researchers willing to approach brain age estimation by using deep learning models  ( 2 min )

Valuing mineral assets is a challenging task that is highly dependent on the supply (geological) uncertainty surrounding resources and reserves, and the uncertainty of demand (commodity prices). In this work, a graph-based reasoning, modeling and solution approach is proposed to jointly address mineral asset valuation and mine plan scheduling and optimization under supply and demand uncertainty in the "mining complex" framework. Three graph-based solutions are proposed: (i) a neural branching policy that learns a block-sampling ore body representation, (ii) a guiding policy that learns to explore a heuristic selection tree, (iii) a hyper-heuristic that manages the value/supply chain optimization and dynamics modeled as a graph structure. Results on two large-scale industrial mining complexes show a reduction of up to three orders of magnitude in primal suboptimality, execution time, and number of iterations, and an increase of up to 40% in the mineral asset value.  ( 2 min )

With the boom of digital educational materials and scalable e-learning systems, the potential for realising AI-assisted personalised learning has skyrocketed. In this landscape, the automatic generation of educational questions will play a key role, enabling scalable self-assessment when a global population is manoeuvring their personalised learning journeys. We develop EduQG, a novel educational question generation model built by adapting a large language model. Our initial experiments demonstrate that EduQG can produce superior educational questions by pre-training on scientific text.  ( 2 min )

The linearised Laplace method for estimating model uncertainty has received renewed attention in the Bayesian deep learning community. The method provides reliable error bars and admits a closed-form expression for the model evidence, allowing for scalable selection of model hyperparameters. In this work, we examine the assumptions behind this method, particularly in conjunction with model selection. We show that these interact poorly with some now-standard tools of deep learning--stochastic approximation methods and normalisation layers--and make recommendations for how to better adapt this classic method to the modern setting. We provide theoretical support for our recommendations and validate them empirically on MLPs, classic CNNs, residual networks with and without normalisation layers, generative autoencoders and transformers.  ( 2 min )

We propose the framework of dual convexified convolutional neural networks (DCCNNs). In this framework, we first introduce a primal learning problem motivated by convexified convolutional neural networks (CCNNs), and then construct the dual convex training program through careful analysis of the Karush-Kuhn-Tucker (KKT) conditions and Fenchel conjugates. Our approach reduces the computational overhead of constructing a large kernel matrix and more importantly, eliminates the ambiguity of factorizing the matrix. Due to the low-rank structure in CCNNs and the related subdifferential of nuclear norms, there is no closed-form expression to recover the primal solution from the dual solution. To overcome this, we propose a highly novel weight recovery algorithm, which takes the dual solution and the kernel information as the input, and recovers the linear weight and the output of convolutional layer, instead of weight parameter. Furthermore, our recovery algorithm exploits the low-rank structure and imposes a small number of filters indirectly, which reduces the parameter size. As a result, DCCNNs inherit all the statistical benefits of CCNNs, while enjoying a more formal and efficient workflow.  ( 2 min )

Information-theoretic Bayesian optimization techniques have become popular for optimizing expensive-to-evaluate black-box functions due to their non-myopic qualities. Entropy Search and Predictive Entropy Search both consider the entropy over the optimum in the input space, while the recent Max-value Entropy Search considers the entropy over the optimal value in the output space. We propose Joint Entropy Search (JES), a novel information-theoretic acquisition function that considers an entirely new quantity, namely the entropy over the joint optimal probability density over both input and output space. To incorporate this information, we consider the reduction in entropy from conditioning on fantasized optimal input/output pairs. The resulting approach primarily relies on standard GP machinery and removes complex approximations typically associated with information-theoretic methods. With minimal computational overhead, JES shows superior decision-making, and yields state-of-the-art performance for information-theoretic approaches across a wide suite of tasks. As a light-weight approach with superior results, JES provides a new go-to acquisition function for Bayesian optimization.  ( 2 min )

In equivariant machine learning the idea is to restrict the learning to a hypothesis class where all the functions are equivariant with respect to some group action. Irreducible representations or invariant theory are typically used to parameterize the space of such functions. In this note, we explicate a general procedure, attributed to Malgrange, to express all polynomial maps between linear spaces that are equivariant with respect to the action of a group $G$, given a characterization of the invariant polynomials on a bigger space. The method also parametrizes smooth equivariant maps in the case that $G$ is a compact Lie group.  ( 2 min )

Recent mean field interpretations of learning dynamics in over-parameterized neural networks offer theoretical insights on the empirical success of first order optimization algorithms in finding global minima of the nonconvex risk landscape. In this paper, we explore applying mean field learning dynamics as a computational algorithm, rather than as an analytical tool. Specifically, we design a Sinkhorn regularized proximal algorithm to approximate the distributional flow from the learning dynamics in the mean field regime over weighted point clouds. In this setting, a contractive fixed point recursion computes the time-varying weights, numerically realizing the interacting Wasserstein gradient flow of the parameter distribution supported over the neuronal ensemble. An appealing aspect of the proposed algorithm is that the measure-valued recursions allow meshless computation. We demonstrate the proposed computational framework of interacting weighted particle evolution on binary and multi-class classification. Our algorithm performs gradient descent of the free energy associated with the risk functional.  ( 2 min )

It is common to address the curse of dimensionality in Markov decision processes (MDPs) by exploiting low-rank representations. This motivates much of the recent theoretical study on linear MDPs. However, most approaches require a given representation under unrealistic assumptions about the normalization of the decomposition or introduce unresolved computational challenges in practice. Instead, we consider an alternative definition of linear MDPs that automatically ensures normalization while allowing efficient representation learning via contrastive estimation. The framework also admits confidence-adjusted index algorithms, enabling an efficient and principled approach to incorporating optimism or pessimism in the face of uncertainty. To the best of our knowledge, this provides the first practical representation learning method for linear MDPs that achieves both strong theoretical guarantees and empirical performance. Theoretically, we prove that the proposed algorithm is sample efficient in both the online and offline settings. Empirically, we demonstrate superior performance over existing state-of-the-art model-based and model-free algorithms on several benchmarks.  ( 2 min )

Whether based on models, training data or a combination, classifiers place (possibly complex) input data into one of a relatively small number of output categories. In this paper, we study the structure of the boundary--those points for which a neighbor is classified differently--in the context of an input space that is a graph, so that there is a concept of neighboring inputs, The scientific setting is a model-based naive Bayes classifier for DNA reads produced by Next Generation Sequencers. We show that the boundary is both large and complicated in structure. We create a new measure of uncertainty, called Neighbor Similarity, that compares the result for a point to the distribution of results for its neighbors. This measure not only tracks two inherent uncertainty measures for the Bayes classifier, but also can be implemented, at a computational cost, for classifiers without inherent measures of uncertainty.  ( 2 min )

We study distributed contextual linear bandits with stochastic contexts, where $N$ agents act cooperatively to solve a linear bandit-optimization problem with $d$-dimensional features over the course of $T$ rounds. For this problem, we derive the first ever information-theoretic lower bound $\Omega(dN)$ on the communication cost of any algorithm that performs optimally in a regret minimization setup. We then propose a distributed batch elimination version of the LinUCB algorithm, DisBE-LUCB, where the agents share information among each other through a central server. We prove that the communication cost of DisBE-LUCB matches our lower bound up to logarithmic factors. In particular, for scenarios with known context distribution, the communication cost of DisBE-LUCB is only $\tilde{\mathcal{O}}(dN)$ and its regret is ${\tilde{\mathcal{O}}}(\sqrt{dNT})$, which is of the same order as that incurred by an optimal single-agent algorithm for $NT$ rounds. We also provide similar bounds for practical settings where the context distribution can only be estimated. Therefore, our proposed algorithm is nearly minimax optimal in terms of \emph{both regret and communication cost}. Finally, we propose DecBE-LUCB, a fully decentralized version of DisBE-LUCB, which operates without a central server, where agents share information with their \emph{immediate neighbors} through a carefully designed consensus procedure.  ( 2 min )

In recent years, algorithms and neural architectures based on the Weisfeiler-Leman algorithm, a well-known heuristic for the graph isomorphism problem, have emerged as a powerful tool for machine learning with graphs and relational data. Here, we give a comprehensive overview of the algorithm's use in a machine-learning setting, focusing on the supervised regime. We discuss the theoretical background, show how to use it for supervised graph and node representation learning, discuss recent extensions, and outline the algorithm's connection to (permutation-)equivariant neural architectures. Moreover, we give an overview of current applications and future directions to stimulate further research.  ( 2 min )

Thompson sampling has proven effective across a wide range of stationary bandit environments. However, as we demonstrate in this paper, it can perform poorly when applied to nonstationary environments. We show that such failures are attributed to the fact that, when exploring, the algorithm does not differentiate actions based on how quickly the information acquired loses its usefulness due to nonstationarity. Building upon this insight, we propose predictive sampling, which extends Thompson sampling to do this. We establish a Bayesian regret bound and establish that, in nonstationary bandit environments, the regret incurred by Thompson sampling can far exceed that of predictive sampling. We also present implementations of predictive sampling that scale to complex bandit environments of practical interest in a computationally tractable manner. Through simulations, we demonstrate that predictive sampling outperforms Thompson sampling and other state-of-the-art algorithms across a wide range of nonstationary bandit environments.  ( 2 min )

Denoising diffusion probabilistic models are a promising new class of generative models that mark a milestone in high-quality image generation. This paper showcases their ability to sequentially generate video, surpassing prior methods in perceptual and probabilistic forecasting metrics. We propose an autoregressive, end-to-end optimized video diffusion model inspired by recent advances in neural video compression. The model successively generates future frames by correcting a deterministic next-frame prediction using a stochastic residual generated by an inverse diffusion process. We compare this approach against five baselines on four datasets involving natural and simulation-based videos. We find significant improvements in terms of perceptual quality for all datasets. Furthermore, by introducing a scalable version of the Continuous Ranked Probability Score (CRPS) applicable to video, we show that our model also outperforms existing approaches in their probabilistic frame forecasting ability.  ( 2 min )

Two-level stochastic optimization formulations have become instrumental in a number of machine learning contexts such as continual learning, neural architecture search, adversarial learning, and hyperparameter tuning. Practical stochastic bilevel optimization problems become challenging in optimization or learning scenarios where the number of variables is high or there are constraints. In this paper, we introduce a bilevel stochastic gradient method for bilevel problems with lower-level constraints. We also present a comprehensive convergence theory that covers all inexact calculations of the adjoint gradient (also called hypergradient) and addresses both the lower-level unconstrained and constrained cases. To promote the use of bilevel optimization in large-scale learning, we introduce a practical bilevel stochastic gradient method (BSG-1) that does not require second-order derivatives and, in the lower-level unconstrained case, dismisses any system solves and matrix-vector products.  ( 2 min )

Neural compression algorithms are typically based on autoencoders that require specialized encoder and decoder architectures for different data modalities. In this paper, we propose COIN++, a neural compression framework that seamlessly handles a wide range of data modalities. Our approach is based on converting data to implicit neural representations, i.e. neural functions that map coordinates (such as pixel locations) to features (such as RGB values). Then, instead of storing the weights of the implicit neural representation directly, we store modulations applied to a meta-learned base network as a compressed code for the data. We further quantize and entropy code these modulations, leading to large compression gains while reducing encoding time by two orders of magnitude compared to baselines. We empirically demonstrate the feasibility of our method by compressing various data modalities, from images and audio to medical and climate data.  ( 2 min )

Modern machine learning requires system designers to specify aspects of the learning pipeline, such as losses, architectures, and optimizers. Meta-learning, or learning-to-learn, instead aims to learn those aspects, and promises to unlock greater capabilities with less manual effort. One particularly ambitious goal of meta-learning is to train general-purpose in-context learning algorithms from scratch, using only black-box models with minimal inductive bias. Such a model takes in training data, and produces test-set predictions across a wide range of problems, without any explicit definition of an inference model, training loss, or optimization algorithm. In this paper we show that Transformers and other black-box models can be meta-trained to act as general-purpose in-context learners. We characterize phase transitions between algorithms that generalize, algorithms that memorize, and algorithms that fail to meta-train at all, induced by changes in model size, number of tasks, and meta-optimization. We further show that the capabilities of meta-trained algorithms are bottlenecked by the accessible state size (memory) determining the next prediction, unlike standard models which are thought to be bottlenecked by parameter count. Finally, we propose practical interventions such as biasing the training distribution that improve the meta-training and meta-generalization of general-purpose learning algorithms.  ( 2 min )

A significant body of research in the data sciences considers unfair discrimination against social categories such as race or gender that could occur or be amplified as a result of algorithmic decisions. Simultaneously, real-world disparities continue to exist, even before algorithmic decisions are made. In this work, we draw on insights from the social sciences brought into the realm of causal modeling and constrained optimization, and develop a novel algorithmic framework for tackling pre-existing real-world disparities. The purpose of our framework, which we call the "impact remediation framework," is to measure real-world disparities and discover the optimal intervention policies that could help improve equity or access to opportunity for those who are underserved with respect to an outcome of interest. We develop a disaggregated approach to tackling pre-existing disparities that relaxes the typical set of assumptions required for the use of social categories in structural causal models. Our approach flexibly incorporates counterfactuals and is compatible with various ontological assumptions about the nature of social categories. We demonstrate impact remediation with a hypothetical case study and compare our disaggregated approach to an existing state-of-the-art approach, comparing its structure and resulting policy recommendations. In contrast to most work on optimal policy learning, we explore disparity reduction itself as an objective, explicitly focusing the power of algorithms on reducing inequality.  ( 2 min )

This paper proposes a novel approach to explain the predictions made by data-driven methods. Since such predictions rely heavily on the data used for training, explanations that convey information about how the training data affects the predictions are useful. The paper proposes a novel approach to quantify how different data-clusters of the training data affect a prediction. The quantification is based on Shapley values, a concept which originates from coalitional game theory, developed to fairly distribute the payout among a set of cooperating players. A player's Shapley value is a measure of that player's contribution. Shapley values are often used to quantify feature importance, ie. how features affect a prediction. This paper extends this to cluster importance, letting clusters of the training data act as players in a game where the predictions are the payouts. The novel methodology proposed in this paper lets us explore and investigate how different clusters of the training data affect the predictions made by any black-box model, allowing new aspects of the reasoning and inner workings of a prediction model to be conveyed to the users. The methodology is fundamentally different from existing explanation methods, providing insight which would not be available otherwise, and should complement existing explanation methods, including explanations based on feature importance.  ( 2 min )

Behavioural cloning (BC) is a commonly used imitation learning method to infer a sequential decision-making policy from expert demonstrations. However, when the quality of the data is not optimal, the resulting behavioural policy also performs sub-optimally once deployed. Recently, there has been a surge in offline reinforcement learning methods that hold the promise to extract high-quality policies from sub-optimal historical data. A common approach is to perform regularisation during training, encouraging updates during policy evaluation and/or policy improvement to stay close to the underlying data. In this work, we investigate whether an offline approach to improving the quality of the existing data can lead to improved behavioural policies without any changes in the BC algorithm. The proposed data improvement approach - Trajectory Stitching (TS) - generates new trajectories (sequences of states and actions) by `stitching' pairs of states that were disconnected in the original data and generating their connecting new action. By construction, these new transitions are guaranteed to be highly plausible according to probabilistic models of the environment, and to improve a state-value function. We demonstrate that the iterative process of replacing old trajectories with new ones incrementally improves the underlying behavioural policy. Extensive experimental results show that significant performance gains can be achieved using TS over BC policies extracted from the original data. Furthermore, using the D4RL benchmarking suite, we demonstrate that state-of-the-art results are obtained by combining TS with two existing offline learning methodologies reliant on BC, model-based offline planning (MBOP) and policy constraint (TD3+BC).  ( 2 min )

We construct a universally Bayes consistent learning rule that satisfies differential privacy (DP). We first handle the setting of binary classification and then extend our rule to the more general setting of density estimation (with respect to the total variation metric). The existence of a universally consistent DP learner reveals a stark difference with the distribution-free PAC model. Indeed, in the latter DP learning is extremely limited: even one-dimensional linear classifiers are not privately learnable in this stringent model. Our result thus demonstrates that by allowing the learning rate to depend on the target distribution, one can circumvent the above-mentioned impossibility result and in fact, learn \emph{arbitrary} distributions by a single DP algorithm. As an application, we prove that any VC class can be privately learned in a semi-supervised setting with a near-optimal \emph{labeled} sample complexity of $\tilde{O}(d/\varepsilon)$ labeled examples (and with an unlabeled sample complexity that can depend on the target distribution).  ( 2 min )

In this work, we study the numerical solution of inverse eigenvalue problems from a machine learning perspective. Two different problems are considered: the inverse Strum-Liouville eigenvalue problem for symmetric potentials and the inverse transmission eigenvalue problem for spherically symmetric refractive indices. Firstly, we solve the corresponding direct problems to produce the required eigenvalues datasets in order to train the machine learning algorithms. Next, we consider several examples of inverse problems and compare the performance of each model to predict the unknown potentials and refractive indices respectively, from a given small set of the lowest eigenvalues. The supervised regression models we use are k-Nearest Neighbours, Random Forests and Multi-Layer Perceptron. Our experiments show that these machine learning methods, under appropriate tuning on their parameters, can numerically solve the examined inverse eigenvalue problems.  ( 2 min )

Many dynamical systems exhibit latent states with intrinsic orderings such as "ally", "neutral" and "enemy" relationships in international relations. Such latent states are evidenced through entities' cooperative versus conflictual interactions which are similarly ordered. Models of such systems often involve state-to-action emission and state-to-state transition matrices. It is common practice to assume that the rows of these stochastic matrices are independently sampled from a Dirichlet distribution. However, this assumption discards ordinal information and treats states and actions falsely as order-invariant categoricals, which hinders interpretation and evaluation. To address this problem, we propose the Ordered Matrix Dirichlet (OMD): rows are sampled conditionally dependent such that probability mass is shifted to the right of the matrix as we move down rows. This results in a well-ordered mapping between latent states and observed action types. We evaluate the OMD in two settings: a Hidden Markov Model and a novel Bayesian Dynamic Poisson Tucker Model tailored to political event data. Models built on the OMD recover interpretable latent states and show superior forecasting performance in few-shot settings. We detail the wide applicability of the OMD to other domains where models with Dirichlet-sampled matrices are popular (e.g. topic modeling) and publish user-friendly code.  ( 2 min )

Developing machine learning-based interatomic potentials from ab-initio electronic structure methods remains a challenging task for computational chemistry and materials science. This work studies the capability of transfer learning for efficiently generating chemically accurate interatomic neural network potentials on organic molecules from the MD17 and ANI data sets. We show that pre-training the network parameters on data obtained from density functional calculations considerably improves the sample efficiency of models trained on more accurate ab-initio data. Additionally, we show that fine-tuning with energy labels alone suffices to obtain accurate atomic forces and run large-scale atomistic simulations. We also investigate possible limitations of transfer learning, especially regarding the design and size of the pre-training and fine-tuning data sets. Finally, we provide GM-NN potentials pre-trained and fine-tuned on the ANI-1x and ANI-1ccx data sets, which can easily be fine-tuned on and applied to organic molecules.  ( 2 min )

This paper develops a clustering method that takes advantage of the sturdiness of model-based clustering, while attempting to mitigate some of its pitfalls. First, we note that standard model-based clustering likely leads to the same number of clusters per margin, which seems a rather artificial assumption for a variety of datasets. We tackle this issue by specifying a finite mixture model per margin that allows each margin to have a different number of clusters, and then cluster the multivariate data using a strategy game-inspired algorithm to which we call Reign-and-Conquer. Second, since the proposed clustering approach only specifies a model for the margins -- but leaves the joint unspecified -- it has the advantage of being partially parallelizable; hence, the proposed approach is computationally appealing as well as more tractable for moderate to high dimensions than a `full' (joint) model-based clustering approach. A battery of numerical experiments on artificial data indicate an overall good performance of the proposed methods in a variety of scenarios, and real datasets are used to showcase their application in practice.  ( 2 min )

The paper addresses the problem of finding the causal direction between two associated variables. The proposed solution is to build an autoencoder of their joint distribution and to maximize its estimation capacity relative to both the marginal distributions. It is shown that the resulting two capacities cannot, in general, be equal. This leads to a new criterion for causal discovery: the higher capacity is consistent with the unconstrained choice of a distribution representing the cause while the lower capacity reflects the constraints imposed by the mechanism on the distribution of the effect. Estimation capacity is defined as the ability of the auto-encoder to represent arbitrary datasets. A regularization term forces it to decide which one of the variables to model in a more generic way i.e., while maintaining higher model capacity. The causal direction is revealed by the constraints encountered while encoding the data instead of being measured as a property of the data itself. The idea is implemented and tested using a restricted Boltzmann machine.  ( 2 min )

Many machine learning problems encode their data as a matrix with a possibly very large number of rows and columns. In several applications like neuroscience, image compression or deep reinforcement learning, the principal subspace of such a matrix provides a useful, low-dimensional representation of individual data. Here, we are interested in determining the $d$-dimensional principal subspace of a given matrix from sample entries, i.e. from small random submatrices. Although a number of sample-based methods exist for this problem (e.g. Oja's rule \citep{oja1982simplified}), these assume access to full columns of the matrix or particular matrix structure such as symmetry and cannot be combined as-is with neural networks \citep{baldi1989neural}. In this paper, we derive an algorithm that learns a principal subspace from sample entries, can be applied when the approximate subspace is represented by a neural network, and hence can be scaled to datasets with an effectively infinite number of rows and columns. Our method consists in defining a loss function whose minimizer is the desired principal subspace, and constructing a gradient estimate of this loss whose bias can be controlled. We complement our theoretical analysis with a series of experiments on synthetic matrices, the MNIST dataset \citep{lecun2010mnist} and the reinforcement learning domain PuddleWorld \citep{sutton1995generalization} demonstrating the usefulness of our approach.  ( 2 min )

Variational autoencoders (VAEs) are powerful tools for learning latent representations of data used in a wide range of applications. In practice, VAEs usually require multiple training rounds to choose the amount of information the latent variable should retain. This trade-off between the reconstruction error (distortion) and the KL divergence (rate) is typically parameterized by a hyperparameter $\beta$. In this paper, we introduce Multi-Rate VAE (MR-VAE), a computationally efficient framework for learning optimal parameters corresponding to various $\beta$ in a single training run. The key idea is to explicitly formulate a response function that maps $\beta$ to the optimal parameters using hypernetworks. MR-VAEs construct a compact response hypernetwork where the pre-activations are conditionally gated based on $\beta$. We justify the proposed architecture by analyzing linear VAEs and showing that it can represent response functions exactly for linear VAEs. With the learned hypernetwork, MR-VAEs can construct the rate-distortion curve without additional training and can be deployed with significantly less hyperparameter tuning. Empirically, our approach is competitive and often exceeds the performance of multiple $\beta$-VAEs training with minimal computation and memory overheads.  ( 2 min )

With the boom of digital educational materials and scalable e-learning systems, the potential for realising AI-assisted personalised learning has skyrocketed. In this landscape, the automatic generation of educational questions will play a key role, enabling scalable self-assessment when a global population is manoeuvring their personalised learning journeys. We develop EduQG, a novel educational question generation model built by adapting a large language model. Our initial experiments demonstrate that EduQG can produce superior educational questions by pre-training on scientific text.  ( 2 min )

Counterfactuals are often described as 'retrospective,' focusing on hypothetical alternatives to a realized past. This description relates to an often implicit assumption about the structure and stability of exogenous variables in the system being modeled -- an assumption that is reasonable in many settings where counterfactuals are used. In this work, we consider cases where we might reasonably make a different assumption about exogenous variables, namely, that the exogenous noise terms of each unit do exhibit some unit-specific structure and/or stability. This leads us to a different use of counterfactuals -- a 'forward-looking' rather than 'retrospective' counterfactual. We introduce "counterfactual treatment choice," a type of treatment choice problem that motivates using forward-looking counterfactuals. We then explore how mismatches between interventional versus forward-looking counterfactual approaches to treatment choice, consistent with different assumptions about exogenous noise, can lead to counterintuitive results.  ( 2 min )

Mixtures of regression are a powerful class of models for regression learning with respect to a highly uncertain and heterogeneous response variable of interest. In addition to being a rich predictive model for the response given some covariates, the parameters in this model class provide useful information about the heterogeneity in the data population, which is represented by the conditional distributions for the response given the covariates associated with a number of distinct but latent subpopulations. In this paper, we investigate conditions of strong identifiability, rates of convergence for conditional density and parameter estimation, and the Bayesian posterior contraction behavior arising in finite mixture of regression models, under exact-fitted and over-fitted settings and when the number of components is unknown. This theory is applicable to common choices of link functions and families of conditional distributions employed by practitioners. We provide simulation studies and data illustrations, which shed some light on the parameter learning behavior found in several popular regression mixture models reported in the literature.  ( 2 min )

Influence diagnostics such as influence functions and approximate maximum influence perturbations are popular in machine learning and in AI domain applications. Influence diagnostics are powerful statistical tools to identify influential datapoints or subsets of datapoints. We establish finite-sample statistical bounds, as well as computational complexity bounds, for influence functions and approximate maximum influence perturbations using efficient inverse-Hessian-vector product implementations. We illustrate our results with generalized linear models and large attention based models on synthetic and real data.  ( 2 min )

submitted by /u/pasticciociccio [link] [comments]  ( 44 min )

submitted by /u/Personal-Trainer-541 [link] [comments]  ( 46 min )

NVIDIA's Isaac Gym project revealed GPU's capability of performing massively parallel simulation for gym-style environments. Detailed information can be found in the following paper: [1] Makoviychuk, Viktor, et al. "Isaac Gym: High-Performance GPU Based Physics Simulation For Robot Learning." Thirty-fifth Conference on Neural Information Processing Systems Datasets and Benchmarks Track (Round 2). 2021. At its release, people commented on Twitter that "it is the MNIST moment for reinforcement learning." And over the past year, I saw several follow-up works and tested NVIDIA's implementations. For example, a demo by this blog https://towardsdatascience.com/a-new-era-of-massively-parallel-simulation-a-practical-tutorial-using-elegantrl-5ebc483c3385 ​ The question is, does that technique help advance Reinforcement Learning, as expected? submitted by /u/Capital-Style-6613 [link] [comments]  ( 56 min )

Here is a podcast episode with Jack Parker-Holder from DeepMind where we discuss open-endedness, evolving agents and environments, offline learning with world models, and much more! submitted by /u/thejashGI [link] [comments]  ( 54 min )

submitted by /u/robotphilanthropist [link] [comments]  ( 55 min )

Hi, I'm working on a problem where the agent has two choices at any time step. It can either choose to perform action 1 which ends the sequence or perform action 2 which takes a continuous valued parameter (that the agent needs to choose). I'm not exactly sure how I can model this. Should I model it as two decisions? First have the agent pick between actions 1 and 2 and then if action 2 is picked, have it choose the continuous valued parameter? submitted by /u/theanswerisnt42 [link] [comments]  ( 57 min )

submitted by /u/pasticciociccio [link] [comments]  ( 42 min )

Here is a podcast episode with Jack Parker-Holder from DeepMind where we discuss open-endedness, evolving agents and environments, offline learning with world models, and much more! submitted by /u/thejashGI [link] [comments]  ( 42 min )

submitted by /u/nalr00n [link] [comments]  ( 48 min )

Hello. I just found something on AI about making a screenplay, and it's on a video called Elastic Monkeys. The software is called Story, and it includes a UI to describe your characters. Here's a link to the website. i'm wanting to know how to download it. submitted by /u/Tipene5 [link] [comments]  ( 42 min )

Apologies in advance if this is not the right place to post. I am building an app to help supercharge the productivity of customer support / sales professionals. I have a background in enterprise sales and my cofounder is an expert UI and frontend dev (iOS, web, mobile). We are looking for an AI dev (ML Ops, custom model training, etc) to join our team and help build the product. Feel free to DM directly or comment below to learn more. submitted by /u/pragmaticpirate [link] [comments]  ( 46 min )

submitted by /u/barty777 [link] [comments]  ( 44 min )

Discovering the best portion to sample from an audio file for pitch detection? Assume that we cannot guarantee what the whole audio file will be like, but we know that some of it contains the signal whose pitch we're interested to detect. However, other parts can contain noise, invalid data, ... Is this unfeasible? It sounds like a hard problem. submitted by /u/mavavilj [link] [comments]  ( 48 min )

submitted by /u/Kipyegonn [link] [comments]  ( 43 min )

submitted by /u/PuppetHere [link] [comments]  ( 44 min )

submitted by /u/SudoSharma [link] [comments]  ( 46 min )

submitted by /u/Personal-Trainer-541 [link] [comments]  ( 44 min )

submitted by /u/MindsTyrant [link] [comments]  ( 42 min )

# Tic-Tac-Toe game # global constants X = "X" O = "O" EMPTY = " " TIE = "TIE" NUM_SQUARES = 9 def display_instructions(): """Display game instructions.""" print( """ Welcome to the greatest intellectual challenge of all time: Tic-Tac-Toe. This will be a showdown between your human brain and my silicon processor. You will make your move known by entering a number, 0 - 8. The number will correspond to the board position as illustrated: 0 | 1 | 2 --------- 3 | 4 | 5 --------- 6 | 7 | 8 Prepare yourself, human. The ultimate battle is about to begin. \n """ ) def ask_yes_no(question): """Ask a yes or no question.""" response = None while response not in ("y", "n"): response = input(question).lower() return response def ask_number(question, low, high): """Ask for a number within a range.""" resp…  ( 47 min )

submitted by /u/walt74 [link] [comments]  ( 48 min )

submitted by /u/walt74 [link] [comments]  ( 45 min )

submitted by /u/mmohand [link] [comments]  ( 42 min )

I only need it for editing midjourney AI imagines. Is midjourney the best at the moment? submitted by /u/Thesmallcookie [link] [comments]  ( 45 min )

submitted by /u/wazserd [link] [comments]  ( 61 min )

Everything I say is a lie. I'm lying. Based on your statement, it is impossible to determine whether or not you are lying. This is because you have stated that everything you say is a lie, which means that your statement that you are lying could be false. In other words, if everything you say is a lie, then it is possible that you are actually telling the truth when you say that you are lying. Because of this logical contradiction, it is impossible to determine the truth of your statement. submitted by /u/Sybrsean [link] [comments]  ( 43 min )

Hi, I have a use-case which requires building a universal model to predict what a customer might take (or what we can recommend) as a product' i.e., a customer's next best product offer. At the moment, we have 20 products, and only 4 of those have a model built for them; a model that predicts the propensity of a customer taking that product. From those models, monthly campaigns are launched, and the top 2 deciles (highest propensities) are targeted. One of the complexities here is the products themselves. Some products are loan products (example: personal loans, car loans, home loans, etc.) and others are non-lending products (example: an application, a digital wallet, insurance, etc.). Some of these products are secondary products/byproducts of other products; example: you can only get PF2 if you currently hold PF1 for at least a year, or you can't get HF1 if you currently hold HF1, HF2, or HF3, etc. A customer's personal information (age, nationality, city, region), inflow/outflow transactions, spending habits, salary, balance, current and previous active/closed product holding, etc. are all available. How would you approach this? What model type would work? I assume a universal model wouldn't be the right way, but building a model for each product isn't very practical at the moment. Appreciate the help. submitted by /u/crisler_iden [link] [comments]  ( 64 min )

Hello all! I am trying to build a CNN model which is able to predict the Darts score after throwing 1 until 3 steel tip arrows. Currently my data set is around 10.000 pictures with labels, which looks like this: Name of the picture; Sum of scores, score of arrow 1, score of arrow 2, score of arrow 3, arrow 1 thown, arrow 2 thrown, arrow 3 thrown example: 12_2022-10-12_135955.050, 12, 12, 0, 0, True, True, False 17_2022-10-12_135958.923, 17, 10, 0, 7, True, False, True [....] My approach is to build a multi-label classifier and to use sigmoid activation. I transfered the labels from categorical variable into a numeric variables using one hot encoder. My problem is that the numeric variables can be greater than 1 because all three arrows can be in the same dart field multiple times. Do you think I am on the right track with my approach or do you have any tipps how to go on with the procedure? My problem is that I dont know how to handle the multi labels. Thanks for any idea or tip! submitted by /u/sqrt-1iscomplex [link] [comments]  ( 66 min )

Is there a way to make a neural network that performs only regression to estimate its own error at inference time, without having ground truths for reference? My network predicts N points and I know the [x,y] coordinates for each. On a labeled test set I can compute the distance between each point and the ground truths, however, I want the network to be able to estimate these distances by itself. I do not have separate classes, the network is trained using just the L2 loss between its predicted points and the expected ground truth points. submitted by /u/Alex-S-S [link] [comments]  ( 67 min )

Here is a podcast episode with Jack Parker-Holder from DeepMind where we discuss open-endedness, evolving agents and environments, offline learning with world models, and much more! submitted by /u/thejashGI [link] [comments]  ( 70 min )

New HuggingFace blog post on RLHF: https://huggingface.co/blog/rlhf Motivated by ChatGPT and the lack of conceptually focused resources on the topic. submitted by /u/robotphilanthropist [link] [comments]  ( 66 min )

In audio, I have to generate an image representation of some folder of audio files.Unfortunately, I have to generate a cochleagram and run each audio file through an auditory toolbox 1 by 1. For large datasets this can take hours for each iteration when testing stuff out (different resolutions, number of filterbanks applied, etc). I then have to save off all the features into one flat dataframe on my hard drive for training. A sub problem to this is data augmentation. Pedalboard is a python library that allows for audio data augmentation. However, this must be performed when the audio is still audio, before the cochleagram data is generated using the filterbanks. For this reason, I either need to save the entire augmented dataset in a flat file, and then generate their visual representations, or make all this pre processing part of the CNN, which would make training time unfeasible. Thus, the only augmentations I use are simple image shifts and gaussian blur, when I really could be making use of different convolutional reverbs and other forms of data augmentation using VST plugins. Is this just where things are at right now? I was initially planning on comparing different filterbanks for use as inputs to CNNs, but it seems now a better comparison may be comparing cochleagrams (without audio based augmentation) to mel-spectrograms (with audio based augmentation) , which would allow me to make everything part of the training loop since mel-spectrograms generate much faster. submitted by /u/Oceanboi [link] [comments]  ( 67 min )

I am wondering, is there any relationship between the dimension of the input vector and the ability of the output that it can represent? (e.g. can I say that a 10-dimensional feature vector has better representation ability against a 5-dimensional one, assuming data are sufficient to train a model.) Or if not, can you suggest any reference to the formal induction that illustrates that relationship? submitted by /u/OutOfCharm [link] [comments]  ( 106 min )

Hi there, I have a question which has been answered multiple times on various blogs but I need to find a paper for this. When we know that we have outliers which lets say have valid values and are not artifacts, do we keep them even if they mess up a model's performance? As a person with a PhD in machine learning, it was always clear to me that outliers (when few) are to be deleted de-facto. I've never encountered a dilemma in the literature regarding outliers when training models (but again strictly from the data scientist point of view). In many top AI conferences, KDD, ICML, WWW, etc., it is a common practise to drop outliers to have this small boost in performance as to beat the SOTA methods. I am looking for related literature which studies the ethical impact of removing/maintaining outliers or a review on outlier handling from top AI-conferences. submitted by /u/potato_head_101 [link] [comments]  ( 64 min )

Hey folks, We interviewed Petar Veličković at NeurIPS last week here -- https://www.youtube.com/watch?v=1lkdWduuN14 Categories (Cats for AI) [00:00:00] Algorithmic Reasoning [00:14:44] Extrapolation [00:19:09] Ishan Misra Skit [00:27:50] Graphs (Expander Graph Propagation) [00:29:18] ​ References MLST#60 Geometric Deep Learning Blueprint (Special Edition) https://www.youtube.com/watch?v=bIZB1hIJ4u8 ​ Categories for AI https://cats.for.ai/ Organised by: Andrew Dudzik - DeepMind Bruno Gavranović - University of Strathclyde João Guilherme Araújo - Cohere / Universidade de São Paulo ​ Petar Veličković - DeepMind / University of Cambridge Pim de Haan - University of Amsterdam / Qualcomm AI Research ​ [Petar Veličković] Graph Attention Networks https://arxiv.org/abs/1…  ( 71 min )

What’s your opinion on Causal ML in NLP? Are there any research groups mainly working on this? submitted by /u/ameli__c [link] [comments]  ( 72 min )

Paper: Large language models are not zero-shot communicators (arXiv) Abstract: Despite widespread use of LLMs as conversational agents, evaluations of performance fail to capture a crucial aspect of communication: interpreting language in context. Humans interpret language using beliefs and prior knowledge about the world. For example, we intuitively understand the response "I wore gloves" to the question "Did you leave fingerprints?" as meaning "No". To investigate whether LLMs have the ability to make this type of inference, known as an implicature, we design a simple task and evaluate widely used state-of-the-art models. We find that, despite only evaluating on utterances that require a binary inference (yes or no), most perform close to random. Models adapted to be "aligned with human intent" perform much better, but still show a significant gap with human performance. We present our findings as the starting point for further research into evaluating how LLMs interpret language in context and to drive the development of more pragmatic and useful models of human discourse. Authors: Laura Ruis, Akbir Khan, Stella Biderman, Sara Hooker, Tim Rocktäschel, Edward Grefenstette submitted by /u/mrx-ai [link] [comments]  ( 78 min )

Important paper researching the replication of training data in diffusion models. Very relevant to recent debates around "art theft" and "data laundering". Abstract Cutting-edge diffusion models produce images with high quality and customizability, enabling them to be used for commercial art and graphic design purposes. But do diffusion models create unique works of art, or are they stealing content directly from their training sets? In this work, we study image retrieval frameworks that enable us to compare generated images with training samples and detect when content has been replicated. Applying our frameworks to diffusion models trained on multiple datasets including Oxford flowers, Celeb-A, ImageNet, and LAION, we discuss how factors such as training set size impact rates of content replication. We also identify cases where diffusion models, including the popular Stable Diffusion model, blatantly copy from their training data. Paper: Diffusion Art or Digital Forgery? Investigating Data Replication in Diffusion Models submitted by /u/walt74 [link] [comments]  ( 66 min )

I am aware that one 1x1 convolution is needed for separable convolution but when else is it useful. I see it used in mobilenetv2 before the depthwise separable convolution later in the bottleneck but not sure why. I also see it used with stride 2 when max pooling could be used instead. Could someone please explain the logic behind this. Thanks. submitted by /u/Ananth_A_007 [link] [comments]  ( 67 min )

submitted by /u/hardmaru [link] [comments]  ( 64 min )

This year's fellows will work across research areas including telemonitoring, human-computer interactions, operations research,  AI-mediated socialization, and chemical transformations.  ( 8 min )

This work studies the problem of transfer learning under the functional linear regression model framework, which aims to improve the estimation and prediction of the target model by leveraging the information from related source models. We measure the relatedness between target and source models using Reproducing Kernel Hilbert Spaces (RKHS) norm, allowing the type of information being transferred to be interpreted by the structural properties of the spaces. Two transfer learning algorithms are proposed: one transfers information from source tasks when we know which sources to use, while the other one aggregates multiple transfer learning results from the first algorithm to achieve robust transfer learning without prior information about the sources. Furthermore, we establish the optimal convergence rates for the prediction risk in the target model, making the statistical gain via transfer learning mathematically provable. The theoretical analysis of the prediction risk also provides insights regarding what factors are affecting the transfer learning effect, i.e. what makes source tasks useful to the target task. We demonstrate the effectiveness of the proposed transfer learning algorithms on extensive synthetic data as well as real financial data application.  ( 2 min )

A common assumption in causal inference from observational data is that there is no hidden confounding. Yet it is, in general, impossible to verify the presence of hidden confounding factors from a single dataset. Under the assumption of independent causal mechanisms underlying the data generating process, we demonstrate a way to detect unobserved confounders when having multiple observational datasets coming from different environments. We present a theory for testable conditional independencies that are only absent during hidden confounding and examine cases where we violate its assumptions: degenerate & dependent mechanisms, and faithfulness violations. Additionally, we propose a procedure to test these independencies and study its empirical finite-sample behavior using simulation studies and semi-synthetic data based on a real-world dataset. In most cases, our theory correctly predicts the presence of hidden confounding, particularly when the confounding bias is~large.  ( 2 min )

Understanding when and how much a model gradient leaks information about the training sample is an important question in privacy. In this paper, we present a surprising result: even without training or memorizing the data, we can fully reconstruct the training samples from a single gradient query at a randomly chosen parameter value. We prove the identifiability of the training data under mild conditions: with shallow or deep neural networks and a wide range of activation functions. We also present a statistically and computationally efficient algorithm based on tensor decomposition to reconstruct the training data. As a provable attack that reveals sensitive training data, our findings suggest potential severe threats to privacy, especially in federated learning.  ( 2 min )

Personalised interactive systems such as recommender systems require selecting relevant items dependent on context. Production systems need to identify the items rapidly from very large catalogues which can be efficiently solved using maximum inner product search technology. Offline optimisation of maximum inner product search can be achieved by a relaxation of the discrete problem resulting in policy learning or REINFORCE style learning algorithms. Unfortunately, this relaxation step requires computing a sum over the entire catalogue making the complexity of the evaluation of the gradient (and hence each stochastic gradient descent iterations) linear in the catalogue size. This calculation is untenable in many real world examples such as large catalogue recommender systems, severely limiting the usefulness of this method in practice. In this paper, we derive an excellent approximation of these policy learning algorithms that scale logarithmically with the catalogue size. Our contribution is based upon combining three novel ideas: a new Monte Carlo estimate of the gradient of a policy, the self normalised importance sampling estimator and the use of fast maximum inner product search at training time. Extensive experiments show that our algorithm is an order of magnitude faster than naive approaches yet produces equally good policies.

Black-box machine learning models are now routinely used in high-risk settings, like medical diagnostics, which demand uncertainty quantification to avoid consequential model failures. Conformal prediction is a user-friendly paradigm for creating statistically rigorous uncertainty sets/intervals for the predictions of such models. Critically, the sets are valid in a distribution-free sense: they possess explicit, non-asymptotic guarantees even without distributional assumptions or model assumptions. One can use conformal prediction with any pre-trained model, such as a neural network, to produce sets that are guaranteed to contain the ground truth with a user-specified probability, such as 90%. It is easy-to-understand, easy-to-use, and general, applying naturally to problems arising in the fields of computer vision, natural language processing, deep reinforcement learning, and so on. This hands-on introduction is aimed to provide the reader a working understanding of conformal prediction and related distribution-free uncertainty quantification techniques with one self-contained document. We lead the reader through practical theory for and examples of conformal prediction and describe its extensions to complex machine learning tasks involving structured outputs, distribution shift, time-series, outliers, models that abstain, and more. Throughout, there are many explanatory illustrations, examples, and code samples in Python. With each code sample comes a Jupyter notebook implementing the method on a real-data example; the notebooks can be accessed and easily run using our codebase.

When one observes a sequence of variables $(x_1, y_1), \ldots, (x_n, y_n)$, Conformal Prediction (CP) is a methodology that allows to estimate a confidence set for $y_{n+1}$ given $x_{n+1}$ by merely assuming that the distribution of the data is exchangeable. CP sets have guaranteed coverage for any finite population size $n$. While appealing, the computation of such a set turns out to be infeasible in general, e.g. when the unknown variable $y_{n+1}$ is continuous. The bottleneck is that it is based on a procedure that readjusts a prediction model on data where we replace the unknown target by all its possible values in order to select the most probable one. This requires computing an infinite number of models, which often makes it intractable. In this paper, we combine CP techniques with classical algorithmic stability bounds to derive a prediction set computable with a single model fit. We demonstrate that our proposed confidence set does not lose any coverage guarantees while avoiding the need for data splitting as currently done in the literature. We provide some numerical experiments to illustrate the tightness of our estimation when the sample size is sufficiently large, on both synthetic and real datasets.

We consider semi-supervised binary classification for applications in which data points are naturally grouped (e.g., survey responses grouped by state) and the labeled data is biased (e.g., survey respondents are not representative of the population). The groups overlap in the feature space and consequently the input-output patterns are related across the groups. To model the inherent structure in such data, we assume the partition-projected class-conditional invariance across groups, defined in terms of the group-agnostic feature space. We demonstrate that under this assumption, the group carries additional information about the class, over the group-agnostic features, with provably improved area under the ROC curve. Further assuming invariance of partition-projected class-conditional distributions across both labeled and unlabeled data, we derive a semi-supervised algorithm that explicitly leverages the structure to learn an optimal, group-aware, probability-calibrated classifier, despite the bias in the labeled data. Experiments on synthetic and real data demonstrate the efficacy of our algorithm over suitable baselines and ablative models, spanning standard supervised and semi-supervised learning approaches, with and without incorporating the group directly as a feature.

A fundamental bottleneck in utilising complex machine learning systems for critical applications has been not knowing why they do and what they do, thus preventing the development of any crucial safety protocols. To date, no method exist that can provide full insight into the granularity of the neural network's decision process. In the past, saliency maps were an early attempt at resolving this problem through sensitivity calculations, whereby dimensions of a data point are selected based on how sensitive the output of the system is to them. However, the success of saliency maps has been at best limited, mainly due to the fact that they interpret the underlying learning system through a linear approximation. We present a novel class of methods for generating nonlinear saliency maps which fully account for the nonlinearity of the underlying learning system. While agreeing with linear saliency maps on simple problems where linear saliency maps are correct, they clearly identify more specific drivers of classification on complex examples where nonlinearities are more pronounced. This new class of methods significantly aids interpretability of deep neural networks and related machine learning systems. Crucially, they provide a starting point for their more broad use in serious applications, where 'why' is equally important as 'what'.

We develop methods to learn the correlation potential for a time-dependent Kohn-Sham (TDKS) system in one spatial dimension. We start from a low-dimensional two-electron system for which we can numerically solve the time-dependent Schr\"odinger equation; this yields electron densities suitable for training models of the correlation potential. We frame the learning problem as one of optimizing a least-squares objective subject to the constraint that the dynamics obey the TDKS equation. Applying adjoints, we develop efficient methods to compute gradients and thereby learn models of the correlation potential. Our results show that it is possible to learn values of the correlation potential such that the resulting electron densities match ground truth densities. We also show how to learn correlation potential functionals with memory, demonstrating one such model that yields reasonable results for trajectories outside the training set.

Popular iterative algorithms such as boosting methods and coordinate descent on linear models converge to the maximum $\ell_1$-margin classifier, a.k.a. sparse hard-margin SVM, in high dimensional regimes where the data is linearly separable. Previous works consistently show that many estimators relying on the $\ell_1$-norm achieve improved statistical rates for hard sparse ground truths. We show that surprisingly, this adaptivity does not apply to the maximum $\ell_1$-margin classifier for a standard discriminative setting. In particular, for the noiseless setting, we prove tight upper and lower bounds for the prediction error that match existing rates of order $\frac{\|\wgt\|_1^{2/3}}{n^{1/3}}$ for general ground truths. To complete the picture, we show that when interpolating noisy observations, the error vanishes at a rate of order $\frac{1}{\sqrt{\log(d/n)}}$. We are therefore first to show benign overfitting for the maximum $\ell_1$-margin classifier.

Conformal prediction constructs a confidence set for an unobserved response of a feature vector based on previous identically distributed and exchangeable observations of responses and features. It has a coverage guarantee at any nominal level without additional assumptions on their distribution. Its computation deplorably requires a refitting procedure for all replacement candidates of the target response. In regression settings, this corresponds to an infinite number of model fits. Apart from relatively simple estimators that can be written as pieces of linear function of the response, efficiently computing such sets is difficult, and is still considered as an open problem. We exploit the fact that, \emph{often}, conformal prediction sets are intervals whose boundaries can be efficiently approximated by classical root-finding algorithms. We investigate how this approach can overcome many limitations of formerly used strategies; we discuss its complexity and drawbacks.

In this paper we generalize single-relation pseudo-Riemannian graph embedding models to multi-relational networks, and show that the typical approach of encoding relations as manifold transformations translates from the Riemannian to the pseudo-Riemannian case. In addition we construct a view of relations as separate spacetime submanifolds of multi-time manifolds, and consider an interpolation between a pseudo-Riemannian embedding model and its Wick-rotated Riemannian counterpart. We validate these extensions in the task of link prediction, focusing on flat Lorentzian manifolds, and demonstrate their use in both knowledge graph completion and knowledge discovery in a biological domain.

Recently, there has been great interest in connections between continuous-time dynamical systems and optimization algorithms, notably in the context of accelerated methods for smooth and unconstrained problems. In this paper we extend this perspective to nonsmooth and constrained problems by obtaining differential inclusions associated to novel accelerated variants of the alternating direction method of multipliers (ADMM). Through a Lyapunov analysis, we derive rates of convergence for these dynamical systems in different settings that illustrate an interesting tradeoff between decaying versus constant damping strategies. We also obtain perturbed equations capturing fine-grained details of these methods, which have improved stability and preserve the leading order convergence rates.

We design and implement an adaptive machine learning equalizer that alternates multiple linear and nonlinear computational layers on an FPGA. On-chip training via gradient backpropagation is shown to allow for real-time adaptation to time-varying channel impairments.

We study the concentration phenomenon for discrete-time random dynamical systems with an unbounded state space. We develop a heuristic approach towards obtaining exponential concentration inequalities for dynamical systems using an entirely functional analytic framework. We also show that existence of exponential-type Lyapunov function, compared to the purely deterministic setting, not only implies stability but also exponential concentration inequalities for sampling from the stationary distribution, via \emph{transport-entropy inequality} (T-E). These results have significant impact in \emph{reinforcement learning} (RL) and \emph{controls}, leading to exponential concentration inequalities even for unbounded observables, while neither assuming reversibility nor exact knowledge of random dynamical system (assumptions at heart of concentration inequalities in statistical mechanics and Markov diffusion processes).

Recent work has constructed neural networks that are equivariant to continuous symmetry groups such as 2D and 3D rotations. This is accomplished using explicit Lie group representations to derive the equivariant kernels and nonlinearities. We present three contributions motivated by frontier applications of equivariance beyond rotations and translations. First, we relax the requirement for explicit Lie group representations with a novel algorithm that finds representations of arbitrary Lie groups given only the structure constants of the associated Lie algebra. Second, we provide a self-contained method and software for building Lie group-equivariant neural networks using these representations. Third, we contribute a novel benchmark dataset for classifying objects from relativistic point clouds, and apply our methods to construct the first object-tracking model equivariant to the Poincar\'e group.

The workhorse of machine learning is stochastic gradient descent. To access stochastic gradients, it is common to consider iteratively input/output pairs of a training dataset. Interestingly, it appears that one does not need full supervision to access stochastic gradients, which is the main motivation of this paper. After formalizing the "active labeling" problem, which focuses on active learning with partial supervision, we provide a streaming technique that provably minimizes the ratio of generalization error over the number of samples. We illustrate our technique in depth for robust regression.

Commonly in reinforcement learning (RL), rewards are discounted over time using an exponential function to model time preference, thereby bounding the expected long-term reward. In contrast, in economics and psychology, it has been shown that humans often adopt a hyperbolic discounting scheme, which is optimal when a specific task termination time distribution is assumed. In this work, we propose a theory for continuous-time model-based reinforcement learning generalized to arbitrary discount functions. This formulation covers the case in which there is a non-exponential random termination time. We derive a Hamilton-Jacobi-Bellman (HJB) equation characterizing the optimal policy and describe how it can be solved using a collocation method, which uses deep learning for function approximation. Further, we show how the inverse RL problem can be approached, in which one tries to recover properties of the discount function given decision data. We validate the applicability of our proposed approach on two simulated problems. Our approach opens the way for the analysis of human discounting in sequential decision-making tasks.

Gradient-based first-order convex optimization algorithms find widespread applicability in a variety of domains, including machine learning tasks. Motivated by the recent advances in fixed-time stability theory of continuous-time dynamical systems, we introduce a generalized framework for designing accelerated optimization algorithms with strongest convergence guarantees that further extend to a subclass of non-convex functions. In particular, we introduce the \emph{GenFlow} algorithm and its momentum variant that provably converge to the optimal solution of objective functions satisfying the Polyak-{\L}ojasiewicz (PL) inequality, in a fixed-time. Moreover for functions that admit non-degenerate saddle-points, we show that for the proposed GenFlow algorithm, the time required to evade these saddle-points is bounded uniformly for all initial conditions. Finally, for strongly convex-strongly concave minimax problems whose optimal solution is a saddle point, a similar scheme is shown to arrive at the optimal solution again in a fixed-time. The superior convergence properties of our algorithm are validated experimentally on a variety of benchmark datasets.

Score based approaches to sampling have shown much success as a generative algorithm to produce new samples from a target density given a pool of initial samples. In this work, we consider if we have no initial samples from the target density, but rather $0^{th}$ and $1^{st}$ order oracle access to the log likelihood. Such problems may arise in Bayesian posterior sampling, or in approximate minimization of non-convex functions. Using this knowledge alone, we propose a Monte Carlo method to estimate the score empirically as a particular expectation of a random variable. Using this estimator, we can then run a discrete version of the backward flow SDE to produce samples from the target density. This approach has the benefit of not relying on a pool of initial samples from the target density, and it does not rely on a neural network or other black box model to estimate the score.

Classifying forecasting methods as being either of a "machine learning" or "statistical" nature has become commonplace in parts of the forecasting literature and community, as exemplified by the M4 competition and the conclusion drawn by the organizers. We argue that this distinction does not stem from fundamental differences in the methods assigned to either class. Instead, this distinction is probably of a tribal nature, which limits the insights into the appropriateness and effectiveness of different forecasting methods. We provide alternative characteristics of forecasting methods which, in our view, allow to draw meaningful conclusions. Further, we discuss areas of forecasting which could benefit most from cross-pollination between the ML and the statistics communities.

End-to-end text-to-speech (TTS) systems have been developed for European languages like English and Spanish with state-of-the-art speech quality, prosody, and naturalness. However, development of end-to-end TTS for Indian languages is lagging behind in terms of quality. The challenges involved in such a task are: 1) scarcity of quality training data; 2) low efficiency during training and inference; 3) slow convergence in the case of large vocabulary size. In our work reported in this paper, we have investigated the use of fine-tuning the English-pretrained Tacotron2 model with limited Sanskrit data to synthesize natural sounding speech in Sanskrit in low resource settings. Our experiments show encouraging results, achieving an overall MOS of 3.38 from 37 evaluators with good Sanskrit spoken knowledge. This is really a very good result, considering the fact that the speech data we have used is of duration 2.5 hours only.  ( 2 min )

This paper focuses on a stochastic system identification problem: given time series observations of a stochastic differential equation (SDE) driven by L\'{e}vy $\alpha$-stable noise, estimate the SDE's drift field. For $\alpha$ in the interval $[1,2)$, the noise is heavy-tailed, leading to computational difficulties for methods that compute transition densities and/or likelihoods in physical space. We propose a Fourier space approach that centers on computing time-dependent characteristic functions, i.e., Fourier transforms of time-dependent densities. Parameterizing the unknown drift field using Fourier series, we formulate a loss consisting of the squared error between predicted and empirical characteristic functions. We minimize this loss with gradients computed via the adjoint method. For a variety of one- and two-dimensional problems, we demonstrate that this method is capable of learning drift fields in qualitative and/or quantitative agreement with ground truth fields.  ( 2 min )

Stacking (or stacked generalization) is an ensemble learning method with one main distinctiveness from the rest: even though several base models are trained on the original data set, their predictions are further used as input data for one or more metamodels arranged in at least one extra layer. Composing a stack of models can produce high-performance outcomes, but it usually involves a trial-and-error process. Therefore, our previously developed visual analytics system, StackGenVis, was mainly designed to assist users in choosing a set of top-performing and diverse models by measuring their predictive performance. However, it only employs a single logistic regression metamodel. In this paper, we investigate the impact of alternative metamodels on the performance of stacking ensembles using a novel visualization tool, called MetaStackVis. Our interactive tool helps users to visually explore different singular and pairs of metamodels according to their predictive probabilities and multiple validation metrics, as well as their ability to predict specific problematic data instances. MetaStackVis was evaluated with a usage scenario based on a medical data set and via expert interviews.  ( 2 min )

Dynamical systems are found in innumerable forms across the physical and biological sciences, yet all these systems fall naturally into universal equivalence classes: conservative or dissipative, stable or unstable, compressible or incompressible. Predicting these classes from data remains an essential open challenge in computational physics at which existing time-series classification methods struggle. Here, we propose, \texttt{phase2vec}, an embedding method that learns high-quality, physically-meaningful representations of 2D dynamical systems without supervision. Our embeddings are produced by a convolutional backbone that extracts geometric features from flow data and minimizes a physically-informed vector field reconstruction loss. In an auxiliary training period, embeddings are optimized so that they robustly encode the equations of unseen data over and above the performance of a per-equation fitting method. The trained architecture can not only predict the equations of unseen data, but also, crucially, learns embeddings that respect the underlying semantics of the embedded physical systems. We validate the quality of learned embeddings investigating the extent to which physical categories of input data can be decoded from embeddings compared to standard blackbox classifiers and state-of-the-art time series classification techniques. We find that our embeddings encode important physical properties of the underlying data, including the stability of fixed points, conservation of energy, and the incompressibility of flows, with greater fidelity than competing methods. We finally apply our embeddings to the analysis of meteorological data, showing we can detect climatically meaningful features. Collectively, our results demonstrate the viability of embedding approaches for the discovery of dynamical features in physical systems.  ( 2 min )

The Bayesian additive regression trees (BART) model is an ensemble method extensively and successfully used in regression tasks due to its consistently strong predictive performance and its ability to quantify uncertainty. BART combines "weak" tree models through a set of shrinkage priors, whereby each tree explains a small portion of the variability in the data. However, the lack of smoothness and the absence of a covariance structure over the observations in standard BART can yield poor performance in cases where such assumptions would be necessary. We propose Gaussian processes Bayesian additive regression trees (GP-BART) as an extension of BART which assumes Gaussian process (GP) priors for the predictions of each terminal node among all trees. We illustrate our model on simulated and real data and compare its performance to traditional modelling approaches, outperforming them in many scenarios. An implementation of our method is available in the R package rGPBART available at: https://github.com/MateusMaiaDS/gpbart  ( 2 min )

Estimating the probability of failure for complex real-world systems using high-fidelity computational models is often prohibitively expensive, especially when the probability is small. Exploiting low-fidelity models can make this process more feasible, but merging information from multiple low-fidelity and high-fidelity models poses several challenges. This paper presents a robust multi-fidelity surrogate modeling strategy in which the multi-fidelity surrogate is assembled using an active learning strategy using an on-the-fly model adequacy assessment set within a subset simulation framework for efficient reliability analysis. The multi-fidelity surrogate is assembled by first applying a Gaussian process correction to each low-fidelity model and assigning a model probability based on the model's local predictive accuracy and cost. Three strategies are proposed to fuse these individual surrogates into an overall surrogate model based on model averaging and deterministic/stochastic model selection. The strategies also dictate which model evaluations are necessary. No assumptions are made about the relationships between low-fidelity models, while the high-fidelity model is assumed to be the most accurate and most computationally expensive model. Through two analytical and two numerical case studies, including a case study evaluating the failure probability of Tristructural isotropic-coated (TRISO) nuclear fuels, the algorithm is shown to be highly accurate while drastically reducing the number of high-fidelity model calls (and hence computational cost).  ( 2 min )

We present a new distribution-free conformal prediction algorithm for sequential data (e.g., time series), called the \textit{sequential predictive conformal inference} (\texttt{SPCI}). We specifically account for the nature that the time series data are non-exchangeable, and thus many existing conformal prediction algorithms based on temporal residuals are not applicable. The main idea is to exploit the temporal dependence of conformity scores; thus, the past conformity scores contain information about future ones. Then we cast the problem of conformal prediction interval as predicting the quantile of a future residual, given a prediction algorithm. Theoretically, we establish asymptotic valid conditional coverage upon extending consistency analyses in quantile regression. Using simulation and real-data experiments, we demonstrate a significant reduction in interval width of \texttt{SPCI} compared to other existing methods under the desired empirical coverage.  ( 2 min )

Estimating causal effects has become an integral part of most applied fields. Solving these modern causal questions requires tackling violations of many classical causal assumptions. In this work we consider the violation of the classical no-interference assumption, meaning that the treatment of one individuals might affect the outcomes of another. To make interference tractable, we consider a known network that describes how interference may travel. However, unlike previous work in this area, the radius (and intensity) of the interference experienced by a unit is unknown and can depend on different sub-networks of those treated and untreated that are connected to this unit. We study estimators for the average direct treatment effect on the treated in such a setting. The proposed estimator builds upon a Lepski-like procedure that searches over the possible relevant radii and treatment assignment patterns. In contrast to previous work, the proposed procedure aims to approximate the relevant network interference patterns. We establish oracle inequalities and corresponding adaptive rates for the estimation of the interference function. We leverage such estimates to propose and analyze two estimators for the average direct treatment effect on the treated. We address several challenges steaming from the data-driven creation of the patterns (i.e. feature engineering) and the network dependence. In addition to rates of convergence, under mild regularity conditions, we show that one of the proposed estimators is asymptotically normal and unbiased.  ( 2 min )

Metric Elicitation (ME) is a framework for eliciting classification metrics that better align with implicit user preferences based on the task and context. The existing ME strategy so far is based on the assumption that users can most easily provide preference feedback over classifier statistics such as confusion matrices. This work examines ME, by providing a first ever implementation of the ME strategy. Specifically, we create a web-based ME interface and conduct a user study that elicits users' preferred metrics in a binary classification setting. We discuss the study findings and present guidelines for future research in this direction.  ( 2 min )

With the rapid development of data collection techniques, complex data objects that are not in the Euclidean space are frequently encountered in new statistical applications. Fr\'echet regression model (Peterson & M\"uller 2019) provides a promising framework for regression analysis with metric space-valued responses. In this paper, we introduce a flexible sufficient dimension reduction (SDR) method for Fr\'echet regression to achieve two purposes: to mitigate the curse of dimensionality caused by high-dimensional predictors and to provide a visual inspection tool for Fr\'echet regression. Our approach is flexible enough to turn any existing SDR method for Euclidean (X,Y) into one for Euclidean X and metric space-valued Y. The basic idea is to first map the metric-space valued random object $Y$ to a real-valued random variable $f(Y)$ using a class of functions, and then perform classical SDR to the transformed data. If the class of functions is sufficiently rich, then we are guaranteed to uncover the Fr\'echet SDR space. We showed that such a class, which we call an ensemble, can be generated by a universal kernel. We established the consistency and asymptotic convergence rate of the proposed methods. The finite-sample performance of the proposed methods is illustrated through simulation studies for several commonly encountered metric spaces that include Wasserstein space, the space of symmetric positive definite matrices, and the sphere. We illustrated the data visualization aspect of our method by exploring the human mortality distribution data across countries and by studying the distribution of hematoma density.  ( 2 min )

Changes in real-world dynamic processes are often described in terms of differences in energies $\textbf{E}(\underline{\alpha})$ of a set of spectral-bands $\underline{\alpha}$. Given continuous spectra of two classes $A$ and $B$, or in general, two stochastic processes $S^{(A)}(f)$ and $S^{(B)}(f)$, $f \in \mathbb{R}^+$, we address the ubiquitous problem of identifying a subset of intervals of $f$ called spectral-bands $\underline{\alpha} \subset \mathbb{R}^+$ such that the energies $\textbf{E}(\underline{\alpha})$ of these bands can optimally discriminate between the two classes. We introduce EGO-MDA, an unsupervised method to identify optimal spectral-bands $\underline{\alpha}^*$ for given samples of spectra from two classes. EGO-MDA employs a statistical approach that iteratively minimizes an adjusted multinomial log-likelihood (deviance) criterion $\mathcal{D}(\underline{\alpha},\mathcal{M})$. Here, Mixture Discriminant Analysis (MDA) aims to derive MLE of two GMM distribution parameters, i.e., $\mathcal{M}^* = \underset{\mathcal{M}}{\rm argmin}~\mathcal{D}(\underline{\alpha}, \mathcal{M})$ and identify a classifier that optimally discriminates between two classes for a given spectral representation. The Efficient Global Optimization (EGO) finds the spectral-bands $\underline{\alpha}^* = \underset{\underline{\alpha}}{\rm argmin}~\mathcal{D}(\underline{\alpha},\mathcal{M})$ for given GMM parameters $\mathcal{M}$. For pathological cases of low separation between mixtures and model misspecification, we discuss the effect of the sample size and the number of iterations on the estimates of parameters $\mathcal{M}$ and therefore the classifier performance. A case study on a synthetic data set is provided. In an engineering application of optimal spectral-banding for anomaly tracking, EGO-MDA achieved at least 70% improvement in the median deviance relative to other methods tested.  ( 2 min )

We consider the problem of estimating the optimal transport map between a (fixed) source distribution $P$ and an unknown target distribution $Q$, based on samples from $Q$. The estimation of such optimal transport maps has become increasingly relevant in modern statistical applications, such as generative modeling. At present, estimation rates are only known in a few settings (e.g. when $P$ and $Q$ have densities bounded above and below and when the transport map lies in a H\"older class), which are often not reflected in practice. We present a unified methodology for obtaining rates of estimation of optimal transport maps in general function spaces. Our assumptions are significantly weaker than those appearing in the literature: we require only that the source measure $P$ satisfies a Poincar\'e inequality and that the optimal map be the gradient of a smooth convex function that lies in a space whose metric entropy can be controlled. As a special case, we recover known estimation rates for bounded densities and H\"older transport maps, but also obtain nearly sharp results in many settings not covered by prior work. For example, we provide the first statistical rates of estimation when $P$ is the normal distribution and the transport map is given by an infinite-width shallow neural network.  ( 2 min )

This paper is in the field of stochastic Multi-Armed Bandits (MABs), i.e., those sequential selection techniques able to learn online using only the feedback given by the chosen option (a.k.a. arm). We study a particular case of the rested and restless bandits in which the arms' expected payoff is monotonically non-decreasing. This characteristic allows designing specifically crafted algorithms that exploit the regularity of the payoffs to provide tight regret bounds. We design an algorithm for the rested case (R-ed-UCB) and one for the restless case (R-less-UCB), providing a regret bound depending on the properties of the instance and, under certain circumstances, of $\widetilde{\mathcal{O}}(T^{\frac{2}{3}})$. We empirically compare our algorithms with state-of-the-art methods for non-stationary MABs over several synthetically generated tasks and an online model selection problem for a real-world dataset. Finally, using synthetic and real-world data, we illustrate the effectiveness of the proposed approaches compared with state-of-the-art algorithms for the non-stationary bandits.  ( 2 min )

Emerging real-time multi-model ML (RTMM) workloads such as AR/VR and drone control often involve dynamic behaviors in various levels; task, model, and layers (or, ML operators) within a model. Such dynamic behaviors are new challenges to the system software in an ML system because the overall system load is unpredictable unlike traditional ML workloads. Also, the real-time processing requires to meet deadlines, and multi-model workloads involve highly heterogeneous models. As RTMM workloads often run on resource-constrained devices (e.g., VR headset), developing an effective scheduler is an important research problem. Therefore, we propose a new scheduler, SDRM3, that effectively handles various dynamicity in RTMM style workloads targeting multi-accelerator systems. To make scheduling decisions, SDRM3 quantifies the unique requirements for RTMM workloads and utilizes the quantified scores to drive scheduling decisions, considering the current system load and other inference jobs on different models and input frames. SDRM3 has tunable parameters that provide fast adaptivity to dynamic workload changes based on a gradient descent-like online optimization, which typically converges within five steps for new workloads. In addition, we also propose a method to exploit model level dynamicity based on Supernet for exploiting the trade-off between the scheduling effectiveness and model performance (e.g., accuracy), which dynamically selects a proper sub-network in a Supernet based on the system loads. In our evaluation on five realistic RTMM workload scenarios, SDRM3 reduces the overall UXCost, which is a energy-delay-product (EDP)-equivalent metric for real-time applications defined in the paper, by 37.7% and 53.2% on geometric mean (up to 97.6% and 97.1%) compared to state-of-the-art baselines, which shows the efficacy of our scheduling methodology.  ( 2 min )

A fundamental bottleneck in utilising complex machine learning systems for critical applications has been not knowing why they do and what they do, thus preventing the development of any crucial safety protocols. To date, no method exist that can provide full insight into the granularity of the neural network's decision process. In the past, saliency maps were an early attempt at resolving this problem through sensitivity calculations, whereby dimensions of a data point are selected based on how sensitive the output of the system is to them. However, the success of saliency maps has been at best limited, mainly due to the fact that they interpret the underlying learning system through a linear approximation. We present a novel class of methods for generating nonlinear saliency maps which fully account for the nonlinearity of the underlying learning system. While agreeing with linear saliency maps on simple problems where linear saliency maps are correct, they clearly identify more specific drivers of classification on complex examples where nonlinearities are more pronounced. This new class of methods significantly aids interpretability of deep neural networks and related machine learning systems. Crucially, they provide a starting point for their more broad use in serious applications, where 'why' is equally important as 'what'.

Recent studies in Vision-and-Language Navigation (VLN) train RL agents to execute natural-language navigation instructions in photorealistic environments, as a step towards robots that can follow human instructions. However, given the scarcity of human instruction data and limited diversity in the training environments, these agents still struggle with complex language grounding and spatial language understanding. Pretraining on large text and image-text datasets from the web has been extensively explored but the improvements are limited. We investigate large-scale augmentation with synthetic instructions. We take 500+ indoor environments captured in densely-sampled 360 degree panoramas, construct navigation trajectories through these panoramas, and generate a visually-grounded instruction for each trajectory using Marky, a high-quality multilingual navigation instruction generator. We also synthesize image observations from novel viewpoints using an image-to-image GAN. The resulting dataset of 4.2M instruction-trajectory pairs is two orders of magnitude larger than existing human-annotated datasets, and contains a wider variety of environments and viewpoints. To efficiently leverage data at this scale, we train a simple transformer agent with imitation learning. On the challenging RxR dataset, our approach outperforms all existing RL agents, improving the state-of-the-art NDTW from 71.1 to 79.1 in seen environments, and from 64.6 to 66.8 in unseen test environments. Our work points to a new path to improving instruction-following agents, emphasizing large-scale imitation learning and the development of synthetic instruction generation capabilities.

Recently, model-based agents have achieved better performance than model-free ones using the same computational budget and training time in single-agent environments. However, due to the complexity of multi-agent systems, it is tough to learn the model of the environment. The significant compounding error may hinder the learning process when model-based methods are applied to multi-agent tasks. This paper proposes an implicit model-based multi-agent reinforcement learning method based on value decomposition methods. Under this method, agents can interact with the learned virtual environment and evaluate the current state value according to imagined future states in the latent space, making agents have the foresight. Our approach can be applied to any multi-agent value decomposition method. The experimental results show that our method improves the sample efficiency in different partially observable Markov decision process domains.

Software-related platforms have enabled their users to collaboratively label software entities with topics. Tagging software repositories with relevant topics can be exploited for facilitating various downstream tasks. For instance, a correct and complete set of topics assigned to a repository can increase its visibility. Consequently, this improves the outcome of tasks such as browsing, searching, navigation, and organization of repositories. Unfortunately, assigned topics are usually highly noisy, and some repositories do not have well-assigned topics. Thus, there have been efforts on recommending topics for software projects, however, the semantic relationships among these topics have not been exploited so far. We propose two recommender models for tagging software projects that incorporate the semantic relationship among topics. Our approach has two main phases; (1) we first take a collaborative approach to curate a dataset of quality topics specifically for the domain of software engineering and development. We also enrich this data with the semantic relationships among these topics and encapsulate them in a knowledge graph we call SED-KGraph. Then, (2) we build two recommender systems; The first one operates only based on the list of original topics assigned to a repository and the relationships specified in our knowledge graph. The second predictive model, however, assumes there are no topics available for a repository, hence it proceeds to predict the relevant topics based on both textual information of a software project and SED-KGraph. We built SED-KGraph in a crowd-sourced project with 170 contributors from both academia and industry. The experiment results indicate that our solutions outperform baselines that neglect the semantic relationships among topics by at least 25% and 23% in terms of ASR and MAP metrics.

In this paper, we design a resource management scheme to support stateful applications, which will be prevalent in 6G networks. Different from stateless applications, stateful applications require context data while executing computing tasks from user terminals (UTs). Using a multi-tier computing paradigm with servers deployed at the core network, gateways, and base stations to support stateful applications, we aim to optimize long-term resource reservation by jointly minimizing the usage of computing, storage, and communication resources and the cost from reconfiguring resource reservation. The coupling among different resources and the impact of UT mobility create challenges in resource management. To address the challenges, we develop digital twin (DT) empowered network planning with two elements, i.e., multi-resource reservation and resource reservation reconfiguration. First, DTs are designed for collecting UT status data, based on which UTs are grouped according to their mobility patterns. Second, an algorithm is proposed to customize resource reservation for different groups to satisfy their different resource demands. Last, a Meta-learning-based approach is developed to reconfigure resource reservation for balancing the network resource usage and the reconfiguration cost. Simulation results demonstrate that the proposed DT-empowered network planning outperforms benchmark frameworks by using less resources and incurring lower reconfiguration costs.

Protein structure prediction is a fundamental problem in computational molecular biology. Classical algorithms such as ab-initio or threading as well as many learning methods have been proposed to solve this challenging problem. However, most reinforcement learning methods tend to model the state-action pairs as discrete objects. In this paper, we develop a reinforcement learning (RL) framework in a continuous setting and based on a stochastic parametrized Hamiltonian version of the Pontryagin maximum principle (PMP) to solve the side-chain packing and protein-folding problem. For special cases our formulation can be reduced to previous work where the optimal folding trajectories are trained using an explicit use of Langevin dynamics. Optimal continuous stochastic Hamiltonian dynamics folding pathways can be derived with use of different models of molecular energetics and force fields. In our RL implementation we adopt a soft actor-critic methodology however we can replace this other RL training based on A2C, A3C or PPO.

We study the learning dynamics of self-predictive learning for reinforcement learning, a family of algorithms that learn representations by minimizing the prediction error of their own future latent representations. Despite its recent empirical success, such algorithms have an apparent defect: trivial representations (such as constants) minimize the prediction error, yet it is obviously undesirable to converge to such solutions. Our central insight is that careful designs of the optimization dynamics are critical to learning meaningful representations. We identify that a faster paced optimization of the predictor and semi-gradient updates on the representation, are crucial to preventing the representation collapse. Then in an idealized setup, we show self-predictive learning dynamics carries out spectral decomposition on the state transition matrix, effectively capturing information of the transition dynamics. Building on the theoretical insights, we propose bidirectional self-predictive learning, a novel self-predictive algorithm that learns two representations simultaneously. We examine the robustness of our theoretical insights with a number of small-scale experiments and showcase the promise of the novel representation learning algorithm with large-scale experiments.  ( 2 min )